(4-aminocarbonyl-2-nitro-phenyl)methyl 3-(propan-2-ylsulfamoyl)benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-(propan-2-ylsulfamoyl)benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-(isopropylsulfamoyl)benzoate CAS Name: 3-(propan-2-ylsulfamoyl)benzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-(propan-2-ylsulfamoyl)benzoate Traditional Name: 3-(isopropylsulfamoyl)benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C18H19N3O7S MolecularWeight: 421.42436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O7S/c1-11(2)20-29(26,27)15-5-3-4-13(8-15)18(23)28-10-14-7-6-12(17(19)22)9-16(14)21(24)25/h3-9,11,20H,10H2,1-2H3,(H2,19,22)