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

Systemtic Name: O1-methyl O4-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: 1-O-methyl 4-O-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-2-(4-phenylpiperazino)ethyl] ester O1-methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-27-20(25)16-7-9-17(10-8-16)21(26)28-15-19(24)23-13-11-22(12-14-23)18-5-3-2-4-6-18/h2-10H,11-15H2,1H3