5-[4-(6,7-dimethoxynaphthalen-1-yl)-2-sulfanyl-butoxy]-3,3-dimethyl-1H-indol-2-one

Systemtic Name: 5-[4-(6,7-dimethoxynaphthalen-1-yl)-2-sulfanyl-butoxy]-3,3-dimethyl-1H-indol-2-one Openeye Name: 5-[4-(6,7-dimethoxy-1-naphthyl)-2-sulfanyl-butoxy]-3,3-dimethyl-indolin-2-one CAS Name: 5-[4-(6,7-dimethoxy-1-naphthalenyl)-2-mercaptobutoxy]-3,3-dimethyl-1H-indol-2-one IUPAC Name: 5-[4-(6,7-dimethoxynaphthalen-1-yl)-2-sulfanylbutoxy]-3,3-dimethyl-1H-indol-2-one Traditional Name: 5-[4-(6,7-dimethoxy-1-naphthyl)-2-mercapto-butoxy]-3,3-dimethyl-oxindole Formula: C26H29NO4S MolecularWeight: 451.57776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)OCC(CCC3=CC=CC4=CC(=C(C=C43)OC)OC)S)NC1=O)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)OCC(CCC3=CC=CC4=CC(=C(C=C43)OC)OC)S)NC1=O)C

InChI

InChI=1S/C26H29NO4S/c1-26(2)21-13-18(9-11-22(21)27-25(26)28)31-15-19(32)10-8-16-6-5-7-17-12-23(29-3)24(30-4)14-20(16)17/h5-7,9,11-14,19,32H,8,10,15H2,1-4H3,(H,27,28)