N-[(Z)-3,6-bis(oxidanylidene)tetradec-4-en-7-yn-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(Z)-3,6-bis(oxidanylidene)tetradec-4-en-7-yn-2-yl]-4-methyl-benzenesulfonamide Openeye Name: 4-methyl-N-[(Z)-1-methyl-2,5-dioxo-tridec-3-en-6-ynyl]benzenesulfonamide CAS Name: N-[(Z)-3,6-dioxotetradec-4-en-7-yn-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(Z)-3,6-dioxotetradec-4-en-7-yn-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(Z)-2,5-diketo-1-methyl-tridec-3-en-6-ynyl]-4-methyl-benzenesulfonamide Formula: C21H27NO4S MolecularWeight: 389.50838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(=O)C=CC(=O)C(C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCC#CC(=O)/C=C\C(=O)C(C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C21H27NO4S/c1-4-5-6-7-8-9-10-19(23)13-16-21(24)18(3)22-27(25,26)20-14-11-17(2)12-15-20/h11-16,18,22H,4-8H2,1-3H3/b16-13-