3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one Openeye Name: 1-(4-nitrophenyl)-3-(p-tolylsulfonyl)propan-1-one CAS Name: 3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-1-propanone IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one Traditional Name: 1-(4-nitrophenyl)-3-tosyl-propan-1-one Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5S/c1-12-2-8-15(9-3-12)23(21,22)11-10-16(18)13-4-6-14(7-5-13)17(19)20/h2-9H,10-11H2,1H3