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

Systemtic Name: 5-chloranyl-3-(phenylmethyl)-1H-indole-2-carboxylic acid Openeye Name: 3-benzyl-5-chloro-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-(phenylmethyl)-1H-indole-2-carboxylic acid IUPAC Name: 3-benzyl-5-chloro-1H-indole-2-carboxylic acid Traditional Name: 3-benzyl-5-chloro-1H-indole-2-carboxylic acid Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

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