1-[(3-chloranyl-1-phenyl-indol-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-chloranyl-1-phenyl-indol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-chloro-1-phenyl-indol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-chloro-1-phenyl-2-indolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-chloro-1-phenylindol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-chloro-1-phenyl-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=C(C3=CC=CC=C3N2C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=C(C3=CC=CC=C3N2C4=CC=CC=C4)Cl

InChI

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