2-[(4-tert-butylcyclohexyl)methyl]-3-oxidanylidene-indene-1-carboxylic acid

Systemtic Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-oxidanylidene-indene-1-carboxylic acid Openeye Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-oxo-indene-1-carboxylic acid CAS Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-oxo-1-indenecarboxylic acid IUPAC Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-oxoindene-1-carboxylic acid Traditional Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-keto-indene-1-carboxylic acid Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)CC2=C(C3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)CC2=C(C3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C21H26O3/c1-21(2,3)14-10-8-13(9-11-14)12-17-18(20(23)24)15-6-4-5-7-16(15)19(17)22/h4-7,13-14H,8-12H2,1-3H3,(H,23,24)