ethyl 4-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5/c1-3-31-22(28)25-13-11-24(12-14-25)20(17-7-5-4-6-8-17)21(27)23-18-10-9-16(2)15-19(18)26(29)30/h4-10,15,20H,3,11-14H2,1-2H3,(H,23,27)