4-methyl-N-[(S)-[(1S,3Z)-2-oxidanylidenecyclooct-3-en-1-yl]-phenyl-methyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(S)-[(1S,3Z)-2-oxidanylidenecyclooct-3-en-1-yl]-phenyl-methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[(S)-[(1S,3Z)-2-oxocyclooct-3-en-1-yl]-phenyl-methyl]benzenesulfonamide CAS Name: 4-methyl-N-[(S)-[(1S,3Z)-2-oxo-1-cyclooct-3-enyl]-phenylmethyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(S)-[(1S,3Z)-2-oxocyclooct-3-en-1-yl]-phenylmethyl]benzenesulfonamide Traditional Name: N-[(S)-[(1S,3Z)-2-ketocyclooct-3-en-1-yl]-phenyl-methyl]-4-methyl-benzenesulfonamide Formula: C22H25NO3S MolecularWeight: 383.5038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2CCCCC=CC2=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@@H]2CCCC/C=C\C2=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3S/c1-17-13-15-19(16-14-17)27(25,26)23-22(18-9-5-4-6-10-18)20-11-7-2-3-8-12-21(20)24/h4-6,8-10,12-16,20,22-23H,2-3,7,11H2,1H3/b12-8-/t20-,22-/m1/s1