O4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl] ester O1-ethyl ester Formula: C18H21ClN2O5 MolecularWeight: 380.82274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H21ClN2O5/c1-2-25-17(23)6-7-18(24)26-13-16(22)21-10-8-20(9-11-21)15-5-3-4-14(19)12-15/h3-7,12H,2,8-11,13H2,1H3/b7-6+