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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1OC(=O)C2=CC=NC=C2)C(=C)C

Isomeric SMILES

CC1=CCC(CC1OC(=O)C2=CC=NC=C2)C(=C)C

InChI

InChI=1S/C16H19NO2/c1-11(2)14-5-4-12(3)15(10-14)19-16(18)13-6-8-17-9-7-13/h4,6-9,14-15H,1,5,10H2,2-3H3