(4-hexadecoxyphenyl) 3-oxidanylidene-3-[4-(4-propylcyclohexyl)phenyl]propanoate

Systemtic Name: (4-hexadecoxyphenyl) 3-oxidanylidene-3-[4-(4-propylcyclohexyl)phenyl]propanoate Openeye Name: (4-hexadecoxyphenyl) 3-oxo-3-[4-(4-propylcyclohexyl)phenyl]propanoate CAS Name: 3-oxo-3-[4-(4-propylcyclohexyl)phenyl]propanoic acid (4-hexadecoxyphenyl) ester IUPAC Name: (4-hexadecoxyphenyl) 3-oxo-3-[4-(4-propylcyclohexyl)phenyl]propanoate Traditional Name: 3-keto-3-[4-(4-propylcyclohexyl)phenyl]propionic acid (4-cetyloxyphenyl) ester Formula: C40H60O4 MolecularWeight: 604.902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)CC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)CC(=O)C2=CC=C(C=C2)C3CCC(CC3)CCC

InChI

InChI=1S/C40H60O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-31-43-37-27-29-38(30-28-37)44-40(42)32-39(41)36-25-23-35(24-26-36)34-21-19-33(18-4-2)20-22-34/h23-30,33-34H,3-22,31-32H2,1-2H3