1-Benzyl-5-methoxy-2-propan-2-ylindole-3-carboxylic acid

HCID 58986331
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Basic information

Standard SMILES
COc1ccc2c(c1)c(C(=O)O)c(C(C)C)n2Cc1ccccc1
InChIKey
WYIOUFXFNSUXLU-UHFFFAOYSA-N
Molecular formula
C20H21NO3
Average molar mass
323.4 g/mol
Monoisotopic mass
323.15214353

Names & identifiers

Preferred name
1-Benzyl-5-methoxy-2-propan-2-ylindole-3-carboxylic acid
IUPAC
1-benzyl-5-methoxy-2-propan-2-ylindole-3-carboxylic acid

Names & synonyms

SCHEMBL336644

Database identifiers

PubChem CID
58986331

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
51.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
24

Related reactions

1 records
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Compound notes

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