(4Z)-6,7-dimethoxy-4-(2-methyl-2-oxidanyl-propylidene)-2-(phenylsulfonyl)-1,3-dihydroisoquinoline-5,8-dione

Systemtic Name: (4Z)-6,7-dimethoxy-4-(2-methyl-2-oxidanyl-propylidene)-2-(phenylsulfonyl)-1,3-dihydroisoquinoline-5,8-dione Openeye Name: (4Z)-2-(benzenesulfonyl)-4-(2-hydroxy-2-methyl-propylidene)-6,7-dimethoxy-1,3-dihydroisoquinoline-5,8-dione CAS Name: (4Z)-2-(benzenesulfonyl)-4-(2-hydroxy-2-methylpropylidene)-6,7-dimethoxy-1,3-dihydroisoquinoline-5,8-dione IUPAC Name: (4Z)-2-(benzenesulfonyl)-4-(2-hydroxy-2-methylpropylidene)-6,7-dimethoxy-1,3-dihydroisoquinoline-5,8-dione Traditional Name: (4Z)-2-besyl-4-(2-hydroxy-2-methyl-propylidene)-6,7-dimethoxy-1,3-dihydroisoquinoline-5,8-quinone Formula: C21H23NO7S MolecularWeight: 433.47482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C1CN(CC2=C1C(=O)C(=C(C2=O)OC)OC)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(/C=C/1\CN(CC2=C1C(=O)C(=C(C2=O)OC)OC)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H23NO7S/c1-21(2,25)10-13-11-22(30(26,27)14-8-6-5-7-9-14)12-15-16(13)18(24)20(29-4)19(28-3)17(15)23/h5-10,25H,11-12H2,1-4H3/b13-10+