3-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]benzoic acid Openeye Name: 3-[[4-(1H-indol-3-yl)-1-piperidyl]methyl]benzoic acid CAS Name: 3-[[4-(1H-indol-3-yl)-1-piperidinyl]methyl]benzoic acid IUPAC Name: 3-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]benzoic acid Traditional Name: 3-[[4-(1H-indol-3-yl)piperidino]methyl]benzoic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=CC=CC=C32)CC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CNC3=CC=CC=C32)CC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H22N2O2/c24-21(25)17-5-3-4-15(12-17)14-23-10-8-16(9-11-23)19-13-22-20-7-2-1-6-18(19)20/h1-7,12-13,16,22H,8-11,14H2,(H,24,25)