(E)-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)but-3-en-2-one

Systemtic Name: (E)-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)but-3-en-2-one Openeye Name: (E)-4-(3-nitrophenyl)-3-(p-tolylsulfonyl)but-3-en-2-one CAS Name: (E)-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-3-buten-2-one IUPAC Name: (E)-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)but-3-en-2-one Traditional Name: (E)-4-(3-nitrophenyl)-3-tosyl-but-3-en-2-one Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)C

InChI

InChI=1S/C17H15NO5S/c1-12-6-8-16(9-7-12)24(22,23)17(13(2)19)11-14-4-3-5-15(10-14)18(20)21/h3-11H,1-2H3/b17-11+