4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-2H-inden-5-yl)prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-2H-inden-5-yl)prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-indan-5-yl)prop-1-enyl]benzoic acid CAS Name: 4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-2H-inden-5-yl)prop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-2H-inden-5-yl)prop-1-enyl]benzoic acid Traditional Name: 4-[(E)-2-(6-heptyl-1,1,3,3-tetramethyl-indan-5-yl)prop-1-enyl]benzoic acid Formula: C30H40O2 MolecularWeight: 432.6374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C=C1C(=CC3=CC=C(C=C3)C(=O)O)C)C(CC2(C)C)(C)C

Isomeric SMILES

CCCCCCCC1=CC2=C(C=C1/C(=C/C3=CC=C(C=C3)C(=O)O)/C)C(CC2(C)C)(C)C

InChI

InChI=1S/C30H40O2/c1-7-8-9-10-11-12-24-18-26-27(30(5,6)20-29(26,3)4)19-25(24)21(2)17-22-13-15-23(16-14-22)28(31)32/h13-19H,7-12,20H2,1-6H3,(H,31,32)/b21-17+