[2-(cyclohexylcarbonylamino)-2-oxidanylidene-ethyl] 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: [2-(cyclohexylcarbonylamino)-2-oxidanylidene-ethyl] 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: [2-(cyclohexanecarbonylamino)-2-oxo-ethyl] 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetic acid [2-[[cyclohexyl(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexanecarbonylamino)-2-oxoethyl] 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetic acid [2-(cyclohexanecarbonylamino)-2-keto-ethyl] ester Formula: C19H26N4O8S MolecularWeight: 470.49674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)NC(=O)C2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)NC(=O)C2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O8S/c1-22(2)15-9-8-14(10-16(15)23(27)28)32(29,30)20-11-18(25)31-12-17(24)21-19(26)13-6-4-3-5-7-13/h8-10,13,20H,3-7,11-12H2,1-2H3,(H,21,24,26)