octyl 4-[4-(4-oxidanylidenecyclohexyl)phenyl]benzoate

Systemtic Name: octyl 4-[4-(4-oxidanylidenecyclohexyl)phenyl]benzoate Openeye Name: octyl 4-[4-(4-oxocyclohexyl)phenyl]benzoate CAS Name: 4-[4-(4-oxocyclohexyl)phenyl]benzoic acid octyl ester IUPAC Name: octyl 4-[4-(4-oxocyclohexyl)phenyl]benzoate Traditional Name: 4-[4-(4-ketocyclohexyl)phenyl]benzoic acid octyl ester Formula: C27H34O3 MolecularWeight: 406.55706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(=O)CC3

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(=O)CC3

InChI

InChI=1S/C27H34O3/c1-2-3-4-5-6-7-20-30-27(29)25-14-12-23(13-15-25)21-8-10-22(11-9-21)24-16-18-26(28)19-17-24/h8-15,24H,2-7,16-20H2,1H3