2-(3,4-dimethylphenyl)sulfanyl-1-(4-methyl-3-nitro-phenyl)ethanone

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(4-methyl-3-nitro-phenyl)ethanone Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(4-methyl-3-nitro-phenyl)ethanone CAS Name: 2-[(3,4-dimethylphenyl)thio]-1-(4-methyl-3-nitrophenyl)ethanone IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-1-(4-methyl-3-nitrophenyl)ethanone Traditional Name: 2-[(3,4-dimethylphenyl)thio]-1-(4-methyl-3-nitro-phenyl)ethanone Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO3S/c1-11-5-7-15(8-13(11)3)22-10-17(19)14-6-4-12(2)16(9-14)18(20)21/h4-9H,10H2,1-3H3