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

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

Click to see the large picture

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=C(C=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=C(C=C4)OCC5=CC=CC=C5

InChI

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