[2-oxidanylidene-2-[4-(4-propylcyclohexyl)phenyl]ethyl] 4-butoxybenzoate

Systemtic Name: [2-oxidanylidene-2-[4-(4-propylcyclohexyl)phenyl]ethyl] 4-butoxybenzoate Openeye Name: [2-oxo-2-[4-(4-propylcyclohexyl)phenyl]ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-oxo-2-[4-(4-propylcyclohexyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(4-propylcyclohexyl)phenyl]ethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-[4-(4-propylcyclohexyl)phenyl]ethyl] ester Formula: C28H36O4 MolecularWeight: 436.58304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC

InChI

InChI=1S/C28H36O4/c1-3-5-19-31-26-17-15-25(16-18-26)28(30)32-20-27(29)24-13-11-23(12-14-24)22-9-7-21(6-4-2)8-10-22/h11-18,21-22H,3-10,19-20H2,1-2H3