1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)indole-6-carboxylic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)indole-6-carboxylic acid Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)indole-6-carboxylic acid CAS Name: 1-[(2-chlorophenyl)methyl]-3-(2-methyl-1-oxopropyl)-6-indolecarboxylic acid IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(2-methylpropanoyl)indole-6-carboxylic acid Traditional Name: 1-(2-chlorobenzyl)-3-isobutyryl-indole-6-carboxylic acid Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CN(C2=C1C=CC(=C2)C(=O)O)CC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C(=O)C1=CN(C2=C1C=CC(=C2)C(=O)O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H18ClNO3/c1-12(2)19(23)16-11-22(10-14-5-3-4-6-17(14)21)18-9-13(20(24)25)7-8-15(16)18/h3-9,11-12H,10H2,1-2H3,(H,24,25)