ethyl 3-[(2,6-dimethoxyphenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate

Systemtic Name: ethyl 3-[(2,6-dimethoxyphenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate Openeye Name: ethyl 4-(4-benzoylpiperazin-1-yl)-3-[(2,6-dimethoxybenzoyl)amino]benzoate CAS Name: 4-(4-benzoyl-1-piperazinyl)-3-[[(2,6-dimethoxyphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-benzoylpiperazin-1-yl)-3-[(2,6-dimethoxybenzoyl)amino]benzoate Traditional Name: 4-(4-benzoylpiperazino)-3-[(2,6-dimethoxybenzoyl)amino]benzoic acid ethyl ester Formula: C29H31N3O6 MolecularWeight: 517.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=C(C=CC=C4OC)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=C(C=CC=C4OC)OC

InChI

InChI=1S/C29H31N3O6/c1-4-38-29(35)21-13-14-23(31-15-17-32(18-16-31)28(34)20-9-6-5-7-10-20)22(19-21)30-27(33)26-24(36-2)11-8-12-25(26)37-3/h5-14,19H,4,15-18H2,1-3H3,(H,30,33)