3-[1-(2-chlorophenyl)-3-oxidanylidene-butyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[1-(2-chlorophenyl)-3-oxidanylidene-butyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[1-(2-chlorophenyl)-3-oxo-butyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[1-(2-chlorophenyl)-3-oxobutyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[1-(2-chlorophenyl)-3-oxobutyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[1-(2-chlorophenyl)-3-keto-butyl]-1-methyl-indole-2-carboxylic acid Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1Cl)C2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CC(=O)CC(C1=CC=CC=C1Cl)C2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

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