1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[1H-indol-3-yl-(3-methoxyphenyl)methyl]isonipecotic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C22H24N2O3/c1-27-17-6-4-5-16(13-17)21(24-11-9-15(10-12-24)22(25)26)19-14-23-20-8-3-2-7-18(19)20/h2-8,13-15,21,23H,9-12H2,1H3,(H,25,26)