(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(3-nitrophenyl)sulfonylamino]benzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(3-nitrophenyl)sulfonylamino]benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-[(3-nitrophenyl)sulfonylamino]benzoate CAS Name: 2-[(3-nitrophenyl)sulfonylamino]benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-[(3-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[(3-nitrophenyl)sulfonylamino]benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C19H17N3O7S MolecularWeight: 431.41918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O7S/c1-12-17(13(2)29-20-12)11-28-19(23)16-8-3-4-9-18(16)21-30(26,27)15-7-5-6-14(10-15)22(24)25/h3-10,21H,11H2,1-2H3