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propan-2-yl N-[(2S)-7-bromo-1H,2H,3H,4H-cyclopenta[b]indol-2-yl]carbamate

HCID 45588342
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)OC(=O)N[C@@H]1Cc2[nH]c3ccc(Br)cc3c2C1
InChIKey
SOEQTVSZOBRUER-JTQLQIEISA-N
Molecular formula
C15H17BrN2O2
Average molar mass
337.21 g/mol

Names & identifiers

Preferred name
propan-2-yl N-[(2S)-7-bromo-1H,2H,3H,4H-cyclopenta[b]indol-2-yl]carbamate
IUPAC
propan-2-yl N-[(2S)-7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl]carbamate

Names & synonyms

1212283-31-2propan-2-yl N-[(2S)-7-bromo-1H,2H,3H,4H-cyclopenta[b]indol-2-yl]carbamateMFCD13193067propan-2-yl N-[(2S)-7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl]carbamateSCHEMBL1758752SOEQTVSZOBRUER-JTQLQIEISA-NAKOS005072882AKOS015835435((S)-7-Bromo-1,2,3,4-tetrahydro-cyclopenta[b]indol-2-yl)-carbamic acid isopropyl esterH-20253(S)-Isopropyl(7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl)carbamateIsopropyl (S)-(7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl)carbamate
Show more names
isopropyl N-[(2S)-7-bromo-1,2,3,4-tetrahydrocyclopenta[b]indol-2-yl]carbamate

Database identifiers

PubChem CID
45588342

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
54.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
377

Related reactions

2 records
New reaction record
HRID 1928578 reaction equation
HRID 1928578As productuspto-grants-2012_05
HRID 1928579 reaction equation
HRID 1928579As reactantuspto-grants-2012_05

Compound notes

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