[(2R)-1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: [(2R)-1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: [(1R)-1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [(2R)-1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3-nitroanilino)-1-oxopropan-2-yl] 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [(1R)-2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C18H18ClN3O7S MolecularWeight: 455.86942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)Cl

InChI

InChI=1S/C18H18ClN3O7S/c1-11(17(23)20-12-5-4-6-13(9-12)22(25)26)29-18(24)15-10-14(7-8-16(15)19)30(27,28)21(2)3/h4-11H,1-3H3,(H,20,23)/t11-/m1/s1