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

Systemtic Name: phenyl 4-(5-nonylpyridin-2-yl)-4-propyl-cyclohexane-1-carboxylate Openeye Name: phenyl 4-(5-nonyl-2-pyridyl)-4-propyl-cyclohexanecarboxylate CAS Name: 4-(5-nonyl-2-pyridinyl)-4-propyl-1-cyclohexanecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(5-nonylpyridin-2-yl)-4-propylcyclohexane-1-carboxylate Traditional Name: 4-(5-nonyl-2-pyridyl)-4-propyl-cyclohexanecarboxylic acid phenyl ester Formula: C30H43NO2 MolecularWeight: 449.66792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H43NO2/c1-3-5-6-7-8-9-11-14-25-17-18-28(31-24-25)30(21-4-2)22-19-26(20-23-30)29(32)33-27-15-12-10-13-16-27/h10,12-13,15-18,24,26H,3-9,11,14,19-23H2,1-2H3