[5-methyl-2-(6-methylhept-5-en-2-yl)phenyl] pyridine-4-carboxylate

Systemtic Name: [5-methyl-2-(6-methylhept-5-en-2-yl)phenyl] pyridine-4-carboxylate Openeye Name: [2-(1,5-dimethylhex-4-enyl)-5-methyl-phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [5-methyl-2-(6-methylhept-5-en-2-yl)phenyl] ester IUPAC Name: [5-methyl-2-(6-methylhept-5-en-2-yl)phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(1,5-dimethylhex-4-enyl)-5-methyl-phenyl] ester Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)CCC=C(C)C)OC(=O)C2=CC=NC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)CCC=C(C)C)OC(=O)C2=CC=NC=C2

InChI

InChI=1S/C21H25NO2/c1-15(2)6-5-7-17(4)19-9-8-16(3)14-20(19)24-21(23)18-10-12-22-13-11-18/h6,8-14,17H,5,7H2,1-4H3