butyl 4-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzoate

Systemtic Name: butyl 4-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzoate Openeye Name: butyl 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]benzoate CAS Name: 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]benzoic acid butyl ester Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O7S/c1-2-3-10-26-17(21)12-4-6-13(7-5-12)18-27(24,25)14-8-9-16(20)15(11-14)19(22)23/h4-9,11,18,20H,2-3,10H2,1H3