1-[[1-(4-chlorophenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[1-(4-chlorophenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[1-(4-chlorophenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[1-(4-chlorophenyl)-2-indolyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[1-(4-chlorophenyl)indol-2-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[1-(4-chlorophenyl)indol-2-yl]methyl]isonipecotic acid Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=CC3=CC=CC=C3N2C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=CC3=CC=CC=C3N2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN2O2/c22-17-5-7-18(8-6-17)24-19(13-16-3-1-2-4-20(16)24)14-23-11-9-15(10-12-23)21(25)26/h1-8,13,15H,9-12,14H2,(H,25,26)