4-methyl-N-[(4-nitrophenyl)-(6-oxidanylidenecyclohexen-1-yl)methyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(4-nitrophenyl)-(6-oxidanylidenecyclohexen-1-yl)methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[(4-nitrophenyl)-(6-oxocyclohexen-1-yl)methyl]benzenesulfonamide CAS Name: 4-methyl-N-[(4-nitrophenyl)-(6-oxo-1-cyclohexenyl)methyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(4-nitrophenyl)-(6-oxocyclohexen-1-yl)methyl]benzenesulfonamide Traditional Name: N-[(6-ketocyclohexen-1-yl)-(4-nitrophenyl)methyl]-4-methyl-benzenesulfonamide Formula: C20H20N2O5S MolecularWeight: 400.4482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CCCCC2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CCCCC2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5S/c1-14-6-12-17(13-7-14)28(26,27)21-20(18-4-2-3-5-19(18)23)15-8-10-16(11-9-15)22(24)25/h4,6-13,20-21H,2-3,5H2,1H3