[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C24H27N3O8 MolecularWeight: 485.48648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-])NC(=O)C3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=CC=C2[N+](=O)[O-])NC(=O)C3CCCCC3)OC

InChI

InChI=1S/C24H27N3O8/c1-33-20-12-16(18(13-21(20)34-2)26-23(29)15-8-4-3-5-9-15)24(30)35-14-22(28)25-17-10-6-7-11-19(17)27(31)32/h6-7,10-13,15H,3-5,8-9,14H2,1-2H3,(H,25,28)(H,26,29)