4-[2-(3,4-dimethoxyphenyl)ethanoyl]-1-(2,2-diphenylethanoyl)piperazine-2-carboxylic acid

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethanoyl]-1-(2,2-diphenylethanoyl)piperazine-2-carboxylic acid Openeye Name: 4-[2-(3,4-dimethoxyphenyl)acetyl]-1-(2,2-diphenylacetyl)piperazine-2-carboxylic acid CAS Name: 4-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-1-(1-oxo-2,2-diphenylethyl)-2-piperazinecarboxylic acid IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)acetyl]-1-(2,2-diphenylacetyl)piperazine-2-carboxylic acid Traditional Name: 1-(2,2-diphenylacetyl)-4-homoveratroyl-piperazine-2-carboxylic acid Formula: C29H30N2O6 MolecularWeight: 502.5583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCN(C(C2)C(=O)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCN(C(C2)C(=O)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C29H30N2O6/c1-36-24-14-13-20(17-25(24)37-2)18-26(32)30-15-16-31(23(19-30)29(34)35)28(33)27(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,17,23,27H,15-16,18-19H2,1-2H3,(H,34,35)