ethyl 2-(4-chlorophenyl)-2-[4-(4-methoxy-3-nitro-phenyl)carbonylpiperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-(4-chlorophenyl)-2-[4-(4-methoxy-3-nitro-phenyl)carbonylpiperazin-1-yl]ethanoate Openeye Name: ethyl 2-(4-chlorophenyl)-2-[4-(4-methoxy-3-nitro-benzoyl)piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[(4-methoxy-3-nitrophenyl)-oxomethyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-2-[4-(4-methoxy-3-nitrobenzoyl)piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-(4-methoxy-3-nitro-benzoyl)piperazino]acetic acid ethyl ester Formula: C22H24ClN3O6 MolecularWeight: 461.89546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24ClN3O6/c1-3-32-22(28)20(15-4-7-17(23)8-5-15)24-10-12-25(13-11-24)21(27)16-6-9-19(31-2)18(14-16)26(29)30/h4-9,14,20H,3,10-13H2,1-2H3