propyl 4-(4-heptoxyphenyl)-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: propyl 4-(4-heptoxyphenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: propyl 4-(4-heptoxyphenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: 4-(4-heptoxyphenyl)-4-hydroxy-1-cyclohexanecarboxylic acid propyl ester IUPAC Name: propyl 4-(4-heptoxyphenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: 4-(4-heptoxyphenyl)-4-hydroxy-cyclohexanecarboxylic acid propyl ester Formula: C23H36O4 MolecularWeight: 376.52954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2(CCC(CC2)C(=O)OCCC)O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2(CCC(CC2)C(=O)OCCC)O

InChI

InChI=1S/C23H36O4/c1-3-5-6-7-8-18-26-21-11-9-20(10-12-21)23(25)15-13-19(14-16-23)22(24)27-17-4-2/h9-12,19,25H,3-8,13-18H2,1-2H3