methyl 2-(4-tert-butylcyclohexen-1-yl)-3-oxidanylidene-1H-indene-2-carboxylate

Systemtic Name: methyl 2-(4-tert-butylcyclohexen-1-yl)-3-oxidanylidene-1H-indene-2-carboxylate Openeye Name: methyl 2-(4-tert-butylcyclohexen-1-yl)-1-oxo-indane-2-carboxylate CAS Name: 2-(4-tert-butyl-1-cyclohexenyl)-3-oxo-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylcyclohexen-1-yl)-3-oxo-1H-indene-2-carboxylate Traditional Name: 2-(4-tert-butylcyclohexen-1-yl)-1-keto-indane-2-carboxylic acid methyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=CC1)C2(CC3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

CC(C)(C)C1CCC(=CC1)C2(CC3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C21H26O3/c1-20(2,3)15-9-11-16(12-10-15)21(19(23)24-4)13-14-7-5-6-8-17(14)18(21)22/h5-8,11,15H,9-10,12-13H2,1-4H3