O1-methyl O4-[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[2-oxidanylidene-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[2-[4-[anilino(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 1-O-methyl 4-O-[2-oxo-2-[4-(phenylcarbamoyl)piperazin-1-yl]ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-[4-(phenylcarbamoyl)piperazino]ethyl] ester O1-methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O6/c1-30-20(27)16-7-9-17(10-8-16)21(28)31-15-19(26)24-11-13-25(14-12-24)22(29)23-18-5-3-2-4-6-18/h2-10H,11-15H2,1H3,(H,23,29)