1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[1H-indol-3-yl-(3,4,5-trimethoxyphenyl)methyl]isonipecotic acid Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=CNC3=CC=CC=C32)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C24H28N2O5/c1-29-20-12-16(13-21(30-2)23(20)31-3)22(26-10-8-15(9-11-26)24(27)28)18-14-25-19-7-5-4-6-17(18)19/h4-7,12-15,22,25H,8-11H2,1-3H3,(H,27,28)