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

Systemtic Name: 1-[[1-(4-fluorophenyl)indol-2-yl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[[1-(4-fluorophenyl)indol-2-yl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[[1-(4-fluorophenyl)-2-indolyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[[1-(4-fluorophenyl)indol-2-yl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[[1-(4-fluorophenyl)indol-2-yl]methyl]nipecotic acid Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC3=CC=CC=C3N2C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=CC3=CC=CC=C3N2C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C21H21FN2O2/c22-17-7-9-18(10-8-17)24-19(12-15-4-1-2-6-20(15)24)14-23-11-3-5-16(13-23)21(25)26/h1-2,4,6-10,12,16H,3,5,11,13-14H2,(H,25,26)