3-[3-[(2-cyclopentyl-2,6,7-trimethyl-1-oxidanylidene-3H-inden-5-yl)oxymethyl]phenyl]benzoic acid

Systemtic Name: 3-[3-[(2-cyclopentyl-2,6,7-trimethyl-1-oxidanylidene-3H-inden-5-yl)oxymethyl]phenyl]benzoic acid Openeye Name: 3-[3-[(2-cyclopentyl-2,6,7-trimethyl-1-oxo-indan-5-yl)oxymethyl]phenyl]benzoic acid CAS Name: 3-[3-[(2-cyclopentyl-2,6,7-trimethyl-1-oxo-3H-inden-5-yl)oxymethyl]phenyl]benzoic acid IUPAC Name: 3-[3-[(2-cyclopentyl-2,6,7-trimethyl-1-oxo-3H-inden-5-yl)oxymethyl]phenyl]benzoic acid Traditional Name: 3-[3-[(2-cyclopentyl-1-keto-2,6,7-trimethyl-indan-5-yl)oxymethyl]phenyl]benzoic acid Formula: C31H32O4 MolecularWeight: 468.58338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CC(C(=O)C2=C1C)(C)C3CCCC3)OCC4=CC=CC(=C4)C5=CC(=CC=C5)C(=O)O

Isomeric SMILES

CC1=C(C=C2CC(C(=O)C2=C1C)(C)C3CCCC3)OCC4=CC=CC(=C4)C5=CC(=CC=C5)C(=O)O

InChI

InChI=1S/C31H32O4/c1-19-20(2)28-25(17-31(3,29(28)32)26-12-4-5-13-26)16-27(19)35-18-21-8-6-9-22(14-21)23-10-7-11-24(15-23)30(33)34/h6-11,14-16,26H,4-5,12-13,17-18H2,1-3H3,(H,33,34)