(2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-[4-(2,5-dimethylphenyl)sulfonylpiperazino]hexa-2,4-dien-1-one Formula: C18H24N2O3S MolecularWeight: 348.45976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

C/C=C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C18H24N2O3S/c1-4-5-6-7-18(21)19-10-12-20(13-11-19)24(22,23)17-14-15(2)8-9-16(17)3/h4-9,14H,10-13H2,1-3H3/b5-4+,7-6+