heptyl 4-oxidanyl-4-(4-propylphenyl)cyclohexane-1-carboxylate

Systemtic Name: heptyl 4-oxidanyl-4-(4-propylphenyl)cyclohexane-1-carboxylate Openeye Name: heptyl 4-hydroxy-4-(4-propylphenyl)cyclohexanecarboxylate CAS Name: 4-hydroxy-4-(4-propylphenyl)-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-hydroxy-4-(4-propylphenyl)cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-(4-propylphenyl)cyclohexanecarboxylic acid heptyl ester Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)CCC)O

Isomeric SMILES

CCCCCCCOC(=O)C1CCC(CC1)(C2=CC=C(C=C2)CCC)O

InChI

InChI=1S/C23H36O3/c1-3-5-6-7-8-18-26-22(24)20-14-16-23(25,17-15-20)21-12-10-19(9-4-2)11-13-21/h10-13,20,25H,3-9,14-18H2,1-2H3