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

Systemtic Name: heptyl 4-oxidanyl-4-(4-pentoxyphenyl)cyclohexane-1-carboxylate Openeye Name: heptyl 4-hydroxy-4-(4-pentoxyphenyl)cyclohexanecarboxylate CAS Name: 4-hydroxy-4-(4-pentoxyphenyl)-1-cyclohexanecarboxylic acid heptyl ester IUPAC Name: heptyl 4-hydroxy-4-(4-pentoxyphenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amoxyphenyl)-4-hydroxy-cyclohexanecarboxylic acid heptyl ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H40O4/c1-3-5-7-8-10-20-29-24(26)21-15-17-25(27,18-16-21)22-11-13-23(14-12-22)28-19-9-6-4-2/h11-14,21,27H,3-10,15-20H2,1-2H3