[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethyl] 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethyl] 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoate Openeye Name: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxo-ethyl] 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoate CAS Name: 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoic acid [2-[2-(1-cyclohexenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-[(2-methyl-5-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzoic acid [2-[2-(cyclohexen-1-yl)ethylamino]-2-keto-ethyl] ester Formula: C24H27N3O7S MolecularWeight: 501.55208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NCCC3=CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NCCC3=CCCCC3

InChI

InChI=1S/C24H27N3O7S/c1-17-11-12-19(27(30)31)15-22(17)35(32,33)26-21-10-6-5-9-20(21)24(29)34-16-23(28)25-14-13-18-7-3-2-4-8-18/h5-7,9-12,15,26H,2-4,8,13-14,16H2,1H3,(H,25,28)