[5-(4-bromophenyl)-4-(phenylsulfonyl)-1,2-oxazol-3-yl]-(4-nitrophenyl)methanone

Systemtic Name: [5-(4-bromophenyl)-4-(phenylsulfonyl)-1,2-oxazol-3-yl]-(4-nitrophenyl)methanone Openeye Name: [4-(benzenesulfonyl)-5-(4-bromophenyl)isoxazol-3-yl]-(4-nitrophenyl)methanone CAS Name: [4-(benzenesulfonyl)-5-(4-bromophenyl)-3-isoxazolyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(benzenesulfonyl)-5-(4-bromophenyl)-1,2-oxazol-3-yl]-(4-nitrophenyl)methanone Traditional Name: [4-besyl-5-(4-bromophenyl)isoxazol-3-yl]-(4-nitrophenyl)methanone Formula: C22H13BrN2O6S MolecularWeight: 513.31742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(ON=C2C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(ON=C2C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H13BrN2O6S/c23-16-10-6-15(7-11-16)21-22(32(29,30)18-4-2-1-3-5-18)19(24-31-21)20(26)14-8-12-17(13-9-14)25(27)28/h1-13H