phenyl 4-octyl-4-(5-octylpyridin-2-yl)cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-octyl-4-(5-octylpyridin-2-yl)cyclohexane-1-carboxylate Openeye Name: phenyl 4-octyl-4-(5-octyl-2-pyridyl)cyclohexanecarboxylate CAS Name: 4-octyl-4-(5-octyl-2-pyridinyl)-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-octyl-4-(5-octylpyridin-2-yl)cyclohexane-1-carboxylate Traditional Name: 4-octyl-4-(5-octyl-2-pyridyl)cyclohexanecarboxylic acid phenyl ester Formula: C34H51NO2 MolecularWeight: 505.77424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCCCCCC

InChI

InChI=1S/C34H51NO2/c1-3-5-7-9-11-14-18-29-21-22-32(35-28-29)34(25-17-12-10-8-6-4-2)26-23-30(24-27-34)33(36)37-31-19-15-13-16-20-31/h13,15-16,19-22,28,30H,3-12,14,17-18,23-27H2,1-2H3