(2-methyl-5-prop-1-en-2-yl-cyclopenten-1-yl)methyl pyridine-4-carboxylate

Systemtic Name: (2-methyl-5-prop-1-en-2-yl-cyclopenten-1-yl)methyl pyridine-4-carboxylate Openeye Name: (5-isopropenyl-2-methyl-cyclopenten-1-yl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-methyl-5-(1-methylethenyl)-1-cyclopentenyl]methyl ester IUPAC Name: (2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (5-isopropenyl-2-methyl-cyclopenten-1-yl)methyl ester Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC1)C(=C)C)COC(=O)C2=CC=NC=C2

Isomeric SMILES

CC1=C(C(CC1)C(=C)C)COC(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H19NO2/c1-11(2)14-5-4-12(3)15(14)10-19-16(18)13-6-8-17-9-7-13/h6-9,14H,1,4-5,10H2,2-3H3