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

Systemtic Name: 4-[(E)-2-(1,1,3,3-tetramethyl-6-propyl-2H-inden-5-yl)prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-2-(1,1,3,3-tetramethyl-6-propyl-indan-5-yl)prop-1-enyl]benzoic acid CAS Name: 4-[(E)-2-(1,1,3,3-tetramethyl-6-propyl-2H-inden-5-yl)prop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-2-(1,1,3,3-tetramethyl-6-propyl-2H-inden-5-yl)prop-1-enyl]benzoic acid Traditional Name: 4-[(E)-2-(1,1,3,3-tetramethyl-6-propyl-indan-5-yl)prop-1-enyl]benzoic acid Formula: C26H32O2 MolecularWeight: 376.53108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1C(=CC3=CC=C(C=C3)C(=O)O)C)C(CC2(C)C)(C)C

Isomeric SMILES

CCCC1=CC2=C(C=C1/C(=C/C3=CC=C(C=C3)C(=O)O)/C)C(CC2(C)C)(C)C

InChI

InChI=1S/C26H32O2/c1-7-8-20-14-22-23(26(5,6)16-25(22,3)4)15-21(20)17(2)13-18-9-11-19(12-10-18)24(27)28/h9-15H,7-8,16H2,1-6H3,(H,27,28)/b17-13+