hexyl 2-oxidanylidene-3,4-diphenyl-cyclohexane-1-carboxylate

Systemtic Name: hexyl 2-oxidanylidene-3,4-diphenyl-cyclohexane-1-carboxylate Openeye Name: hexyl 2-oxo-3,4-diphenyl-cyclohexanecarboxylate CAS Name: 2-oxo-3,4-diphenyl-1-cyclohexanecarboxylic acid hexyl ester IUPAC Name: hexyl 2-oxo-3,4-diphenylcyclohexane-1-carboxylate Traditional Name: 2-keto-3,4-diphenyl-cyclohexanecarboxylic acid hexyl ester Formula: C25H30O3 MolecularWeight: 378.5039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1CCC(C(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC(=O)C1CCC(C(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H30O3/c1-2-3-4-11-18-28-25(27)22-17-16-21(19-12-7-5-8-13-19)23(24(22)26)20-14-9-6-10-15-20/h5-10,12-15,21-23H,2-4,11,16-18H2,1H3