Methyl 2,3-dimethyl-1-oxo-3,4-dihydroisoquinoline-6-carboxylate

HCID 90985117
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Basic information

Standard SMILES
COC(=O)c1ccc2c(c1)CC(C)N(C)C2=O
InChIKey
GMRBQSDKIGWOOB-UHFFFAOYSA-N
Molecular formula
C13H15NO3
Average molar mass
233.26 g/mol
Monoisotopic mass
233.10519334

Names & identifiers

Preferred name
Methyl 2,3-dimethyl-1-oxo-3,4-dihydroisoquinoline-6-carboxylate
IUPAC
methyl 2,3-dimethyl-1-oxo-3,4-dihydroisoquinoline-6-carboxylate

Database identifiers

PubChem CID
90985117

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

Related reactions

1 records
New reaction record

Linked notes

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