Basic information
- Standard SMILES
COC(=O)c1ccc(NC(=O)c2ccc3c(c2)NCC3)cc1Cl- InChIKey
CJBQPCGXGNAGCW-UHFFFAOYSA-N- Molecular formula
- C17H15ClN2O3
- Average molar mass
- 330.8 g/mol
Names & identifiers
- Preferred name
- 2-chloro-4-[(2,3-dihydro-1H-indole-6-carbonyl)-amino]-benzoic acid methyl ester
- IUPAC
- methyl 2-chloro-4-(2,3-dihydro-1H-indole-6-carbonylamino)benzoate
Names & synonyms
SCHEMBL3574814CJBQPCGXGNAGCW-UHFFFAOYSA-N2-chloro-4-[(2,3-dihydro-1H-indole-6-carbonyl)-amino]-benzoic acid methyl ester
Database identifiers
- PubChem CID
- 68698445
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 459
Related reactions
3 records
Compound notes
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