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

Systemtic Name: 1-[(4-acetamidophenyl)-(1H-indol-3-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-acetamidophenyl)-(1H-indol-3-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-acetamidophenyl)-(1H-indol-3-yl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-acetamidophenyl)-(1H-indol-3-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-acetamidophenyl)-(1H-indol-3-yl)methyl]isonipecotic acid Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H25N3O3/c1-15(27)25-18-8-6-16(7-9-18)22(26-12-10-17(11-13-26)23(28)29)20-14-24-21-5-3-2-4-19(20)21/h2-9,14,17,22,24H,10-13H2,1H3,(H,25,27)(H,28,29)