4-[1-[8-(1-benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid

Systemtic Name: 4-[1-[8-(1-benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Openeye Name: 4-[1-[8-(benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid CAS Name: 4-[1-[8-(1-benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid IUPAC Name: 4-[1-[8-(1-benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Traditional Name: 4-[1-[8-(benzothiophen-2-yl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid Formula: C29H24O2S MolecularWeight: 436.56466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=CC5=CC=CC=C5S4)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=CC5=CC=CC=C5S4)C

InChI

InChI=1S/C29H24O2S/c1-18(19-8-10-20(11-9-19)28(30)31)21-12-13-25-24(16-21)23(14-15-29(25,2)3)27-17-22-6-4-5-7-26(22)32-27/h4-14,16-17H,1,15H2,2-3H3,(H,30,31)