phenyl 4-(5-nonylpyridin-2-yl)-4-pentyl-cyclohexane-1-carboxylate

Systemtic Name: phenyl 4-(5-nonylpyridin-2-yl)-4-pentyl-cyclohexane-1-carboxylate Openeye Name: phenyl 4-(5-nonyl-2-pyridyl)-4-pentyl-cyclohexanecarboxylate CAS Name: 4-(5-nonyl-2-pyridinyl)-4-pentyl-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(5-nonylpyridin-2-yl)-4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amyl-4-(5-nonyl-2-pyridyl)cyclohexanecarboxylic acid phenyl ester Formula: C32H47NO2 MolecularWeight: 477.72108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCCC

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2(CCC(CC2)C(=O)OC3=CC=CC=C3)CCCCC

InChI

InChI=1S/C32H47NO2/c1-3-5-7-8-9-10-12-16-27-19-20-30(33-26-27)32(23-15-6-4-2)24-21-28(22-25-32)31(34)35-29-17-13-11-14-18-29/h11,13-14,17-20,26,28H,3-10,12,15-16,21-25H2,1-2H3