2-methyl-5-nitro-N-[4-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[4-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[4-(5-phenyl-4,5-dihydroisoxazol-3-yl)phenyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[4-(5-phenyl-4,5-dihydroisoxazol-3-yl)phenyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[4-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]benzenesulfonamide Traditional Name: 2-methyl-5-nitro-N-[4-(5-phenyl-2-isoxazolin-3-yl)phenyl]benzenesulfonamide Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O5S/c1-15-7-12-19(25(26)27)13-22(15)31(28,29)24-18-10-8-16(9-11-18)20-14-21(30-23-20)17-5-3-2-4-6-17/h2-13,21,24H,14H2,1H3