methyl 4-[4-(phenylcarbonyl)piperazin-1-yl]-3-[(3-phenylmethoxyphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-[4-(phenylcarbonyl)piperazin-1-yl]-3-[(3-phenylmethoxyphenyl)carbonylamino]benzoate Openeye Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(3-benzyloxybenzoyl)amino]benzoate CAS Name: 4-(4-benzoyl-1-piperazinyl)-3-[[oxo-(3-phenylmethoxyphenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(3-phenylmethoxybenzoyl)amino]benzoate Traditional Name: 3-[(3-benzoxybenzoyl)amino]-4-(4-benzoylpiperazino)benzoic acid methyl ester Formula: C33H31N3O5 MolecularWeight: 549.61634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C33H31N3O5/c1-40-33(39)27-15-16-30(35-17-19-36(20-18-35)32(38)25-11-6-3-7-12-25)29(22-27)34-31(37)26-13-8-14-28(21-26)41-23-24-9-4-2-5-10-24/h2-16,21-22H,17-20,23H2,1H3,(H,34,37)