[4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxidanylidene-butyl] nitrate

Systemtic Name: [4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxidanylidene-butyl] nitrate Openeye Name: [4-[[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylamino]-4-oxo-butyl] nitrate CAS Name: nitric acid [4-[[4-(5-methyl-3-phenyl-4-isoxazolyl)phenyl]sulfonylamino]-4-oxobutyl] ester IUPAC Name: [4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxobutyl] nitrate Traditional Name: nitric acid [4-keto-4-[[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylamino]butyl] ester Formula: C20H19N3O7S MolecularWeight: 445.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NC(=O)CCCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NC(=O)CCCO[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O7S/c1-14-19(20(21-30-14)16-6-3-2-4-7-16)15-9-11-17(12-10-15)31(27,28)22-18(24)8-5-13-29-23(25)26/h2-4,6-7,9-12H,5,8,13H2,1H3,(H,22,24)