[1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(cyclopropylcarbonylamino)benzoate

Systemtic Name: [1-[(4-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(cyclopropylcarbonylamino)benzoate Openeye Name: [1-methyl-2-(4-nitroanilino)-2-oxo-ethyl] 4-(cyclopropanecarbonylamino)benzoate CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]benzoic acid [1-(4-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-nitroanilino)-1-oxopropan-2-yl] 4-(cyclopropanecarbonylamino)benzoate Traditional Name: 4-(cyclopropanecarbonylamino)benzoic acid [2-keto-1-methyl-2-(4-nitroanilino)ethyl] ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)NC(=O)C3CC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C2=CC=C(C=C2)NC(=O)C3CC3

InChI

InChI=1S/C20H19N3O6/c1-12(18(24)21-16-8-10-17(11-9-16)23(27)28)29-20(26)14-4-6-15(7-5-14)22-19(25)13-2-3-13/h4-13H,2-3H2,1H3,(H,21,24)(H,22,25)