decyl 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]pyridine-2-carboxylate

Systemtic Name: decyl 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]pyridine-2-carboxylate Openeye Name: decyl 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]pyridine-2-carboxylate CAS Name: 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)buta-1,3-dienyl]-2-pyridinecarboxylic acid decyl ester IUPAC Name: decyl 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]pyridine-2-carboxylate Traditional Name: 5-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]picolinic acid decyl ester Formula: C30H45NO2 MolecularWeight: 451.6838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=NC=C(C=C1)C=C(C)C=CC2=C(CCCC2(C)C)C

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=NC=C(C=C1)/C=C(\C)/C=C/C2=C(CCCC2(C)C)C

InChI

InChI=1S/C30H45NO2/c1-6-7-8-9-10-11-12-13-21-33-29(32)28-19-17-26(23-31-28)22-24(2)16-18-27-25(3)15-14-20-30(27,4)5/h16-19,22-23H,6-15,20-21H2,1-5H3/b18-16+,24-22+