methyl 2-[1-[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[2-(2-methyl-3-nitro-anilino)-2-oxo-ethyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[2-(2-methyl-3-nitroanilino)-2-oxoethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[2-(2-methyl-3-nitroanilino)-2-oxoethyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-keto-2-(2-methyl-3-nitro-anilino)ethyl]piperazin-2-yl]acetic acid methyl ester Formula: C16H20N4O6 MolecularWeight: 364.3532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCNC(=O)C2CC(=O)OC

InChI

InChI=1S/C16H20N4O6/c1-10-11(4-3-5-12(10)20(24)25)18-14(21)9-19-7-6-17-16(23)13(19)8-15(22)26-2/h3-5,13H,6-9H2,1-2H3,(H,17,23)(H,18,21)