ethyl 4-(3-methylphenyl)-5-[(E)-pent-1-enyl]-2,6-di(propan-2-yl)pyridine-3-carboxylate

Systemtic Name: ethyl 4-(3-methylphenyl)-5-[(E)-pent-1-enyl]-2,6-di(propan-2-yl)pyridine-3-carboxylate Openeye Name: ethyl 2,6-diisopropyl-4-(m-tolyl)-5-[(E)-pent-1-enyl]pyridine-3-carboxylate CAS Name: 4-(3-methylphenyl)-5-[(E)-pent-1-enyl]-2,6-di(propan-2-yl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-methylphenyl)-5-[(E)-pent-1-enyl]-2,6-di(propan-2-yl)pyridine-3-carboxylate Traditional Name: 2,6-diisopropyl-4-(m-tolyl)-5-[(E)-pent-1-enyl]nicotinic acid ethyl ester Formula: C26H35NO2 MolecularWeight: 393.5616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1=C(C(=C(N=C1C(C)C)C(C)C)C(=O)OCC)C2=CC(=CC=C2)C

Isomeric SMILES

CCC/C=C/C1=C(C(=C(N=C1C(C)C)C(C)C)C(=O)OCC)C2=CC(=CC=C2)C

InChI

InChI=1S/C26H35NO2/c1-8-10-11-15-21-22(20-14-12-13-19(7)16-20)23(26(28)29-9-2)25(18(5)6)27-24(21)17(3)4/h11-18H,8-10H2,1-7H3/b15-11+