(Z)-2-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)hept-2-en-1-one

Systemtic Name: (Z)-2-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)hept-2-en-1-one Openeye Name: (Z)-1-(4-nitrophenyl)-2-(p-tolylsulfonyl)hept-2-en-1-one CAS Name: (Z)-2-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-2-hepten-1-one IUPAC Name: (Z)-2-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)hept-2-en-1-one Traditional Name: (Z)-1-(4-nitrophenyl)-2-tosyl-hept-2-en-1-one Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO5S/c1-3-4-5-6-19(27(25,26)18-13-7-15(2)8-14-18)20(22)16-9-11-17(12-10-16)21(23)24/h6-14H,3-5H2,1-2H3/b19-6-