2-chloranyl-1-(phenylmethyl)indole-3-carboxylic acid

Systemtic Name: 2-chloranyl-1-(phenylmethyl)indole-3-carboxylic acid Openeye Name: 1-benzyl-2-chloro-indole-3-carboxylic acid CAS Name: 2-chloro-1-(phenylmethyl)-3-indolecarboxylic acid IUPAC Name: 1-benzyl-2-chloroindole-3-carboxylic acid Traditional Name: 1-benzyl-2-chloro-indole-3-carboxylic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2Cl)C(=O)O

InChI

InChI=1S/C16H12ClNO2/c17-15-14(16(19)20)12-8-4-5-9-13(12)18(15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,19,20)