4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)ethenyl]benzoic acid

Systemtic Name: 4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)ethenyl]benzoic acid Openeye Name: 4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)vinyl]benzoic acid CAS Name: 4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)ethenyl]benzoic acid IUPAC Name: 4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)ethenyl]benzoic acid Traditional Name: 4-[1-(5,5,8,8-tetramethyl-6,7-dihydroanthracen-1-yl)vinyl]benzoic acid Formula: C27H28O2 MolecularWeight: 384.51002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C3C=CC=C(C3=C2)C(=C)C4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=C3C=CC=C(C3=C2)C(=C)C4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C27H28O2/c1-17(18-9-11-19(12-10-18)25(28)29)21-8-6-7-20-15-23-24(16-22(20)21)27(4,5)14-13-26(23,2)3/h6-12,15-16H,1,13-14H2,2-5H3,(H,28,29)