(4-heptylcyclohexyl) 4-cyano-5-decoxy-pyridine-2-carboxylate

Systemtic Name: (4-heptylcyclohexyl) 4-cyano-5-decoxy-pyridine-2-carboxylate Openeye Name: (4-heptylcyclohexyl) 4-cyano-5-decoxy-pyridine-2-carboxylate CAS Name: 4-cyano-5-decoxy-2-pyridinecarboxylic acid (4-heptylcyclohexyl) ester IUPAC Name: (4-heptylcyclohexyl) 4-cyano-5-decoxypyridine-2-carboxylate Traditional Name: 4-cyano-5-decoxy-picolinic acid (4-heptylcyclohexyl) ester Formula: C30H48N2O3 MolecularWeight: 484.71372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(C=C1C#N)C(=O)OC2CCC(CC2)CCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(C=C1C#N)C(=O)OC2CCC(CC2)CCCCCCC

InChI

InChI=1S/C30H48N2O3/c1-3-5-7-9-10-11-13-15-21-34-29-24-32-28(22-26(29)23-31)30(33)35-27-19-17-25(18-20-27)16-14-12-8-6-4-2/h22,24-25,27H,3-21H2,1-2H3