hexyl 4-[4-(4-pentoxyphenyl)phenyl]cyclohexene-1-carboxylate

Systemtic Name: hexyl 4-[4-(4-pentoxyphenyl)phenyl]cyclohexene-1-carboxylate Openeye Name: hexyl 4-[4-(4-pentoxyphenyl)phenyl]cyclohexene-1-carboxylate CAS Name: 4-[4-(4-pentoxyphenyl)phenyl]-1-cyclohexenecarboxylic acid hexyl ester IUPAC Name: hexyl 4-[4-(4-pentoxyphenyl)phenyl]cyclohexene-1-carboxylate Traditional Name: 4-[4-(4-amoxyphenyl)phenyl]cyclohexene-1-carboxylic acid hexyl ester Formula: C30H40O3 MolecularWeight: 448.6368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCCOC(=O)C1=CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC

InChI

InChI=1S/C30H40O3/c1-3-5-7-9-23-33-30(31)28-16-14-26(15-17-28)24-10-12-25(13-11-24)27-18-20-29(21-19-27)32-22-8-6-4-2/h10-13,16,18-21,26H,3-9,14-15,17,22-23H2,1-2H3