4-[1-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid

Systemtic Name: 4-[1-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid Openeye Name: 4-[1-(7-heptoxy-1,1,4,4-tetramethyl-tetralin-6-yl)vinyl]benzoic acid CAS Name: 4-[1-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid IUPAC Name: 4-[1-(3-heptoxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid Traditional Name: 4-[1-(7-heptoxy-1,1,4,4-tetramethyl-tetralin-6-yl)vinyl]benzoic acid Formula: C30H40O3 MolecularWeight: 448.6368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C

InChI

InChI=1S/C30H40O3/c1-7-8-9-10-11-18-33-27-20-26-25(29(3,4)16-17-30(26,5)6)19-24(27)21(2)22-12-14-23(15-13-22)28(31)32/h12-15,19-20H,2,7-11,16-18H2,1,3-6H3,(H,31,32)