[2-(2-methylphenyl)-3-oxidanylidene-3a,4,5,6,7,7a-hexahydroinden-1-yl] 2-ethylhexanoate

Systemtic Name: [2-(2-methylphenyl)-3-oxidanylidene-3a,4,5,6,7,7a-hexahydroinden-1-yl] 2-ethylhexanoate Openeye Name: [2-(o-tolyl)-3-oxo-3a,4,5,6,7,7a-hexahydroinden-1-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(2-methylphenyl)-3-oxo-3a,4,5,6,7,7a-hexahydroinden-1-yl] ester IUPAC Name: [2-(2-methylphenyl)-3-oxo-3a,4,5,6,7,7a-hexahydroinden-1-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [3-keto-2-(o-tolyl)-3a,4,5,6,7,7a-hexahydroinden-1-yl] ester Formula: C24H32O3 MolecularWeight: 368.50908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=C(C(=O)C2C1CCCC2)C3=CC=CC=C3C

Isomeric SMILES

CCCCC(CC)C(=O)OC1=C(C(=O)C2C1CCCC2)C3=CC=CC=C3C

InChI

InChI=1S/C24H32O3/c1-4-6-12-17(5-2)24(26)27-23-20-15-10-9-14-19(20)22(25)21(23)18-13-8-7-11-16(18)3/h7-8,11,13,17,19-20H,4-6,9-10,12,14-15H2,1-3H3