ethyl 3-[4-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-[4-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-[4-[2-(2,3-dimethylanilino)-2-oxo-ethyl]piperazine-1-carbonyl]-5-nitro-benzoate CAS Name: 3-[[4-[2-(2,3-dimethylanilino)-2-oxoethyl]-1-piperazinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-(2,3-dimethylanilino)-2-oxoethyl]piperazine-1-carbonyl]-5-nitrobenzoate Traditional Name: 3-[4-[2-(2,3-dimethylanilino)-2-keto-ethyl]piperazine-1-carbonyl]-5-nitro-benzoic acid ethyl ester Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC(=C3C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC(=C3C)C)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O6/c1-4-34-24(31)19-12-18(13-20(14-19)28(32)33)23(30)27-10-8-26(9-11-27)15-22(29)25-21-7-5-6-16(2)17(21)3/h5-7,12-14H,4,8-11,15H2,1-3H3,(H,25,29)