methyl (2R)-2-[4-(4-aminocarbonyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate

Systemtic Name: methyl (2R)-2-[4-(4-aminocarbonyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-chlorophenyl)ethanoate Openeye Name: methyl (2R)-2-[4-(4-carbamoyl-2-nitro-phenyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate CAS Name: (2R)-2-[4-(4-carbamoyl-2-nitrophenyl)-1-piperazinyl]-2-(2-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl (2R)-2-[4-(4-carbamoyl-2-nitrophenyl)piperazin-1-yl]-2-(2-chlorophenyl)acetate Traditional Name: (2R)-2-[4-(4-carbamoyl-2-nitro-phenyl)piperazino]-2-(2-chlorophenyl)acetic acid methyl ester Formula: C20H21ClN4O5 MolecularWeight: 432.85754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1Cl)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClN4O5/c1-30-20(27)18(14-4-2-3-5-15(14)21)24-10-8-23(9-11-24)16-7-6-13(19(22)26)12-17(16)25(28)29/h2-7,12,18H,8-11H2,1H3,(H2,22,26)/t18-/m1/s1