methyl 1-acetyloxy-2-(2,6,6-trimethylcyclohexen-1-yl)-2H-pyridine-4-carboxylate

Systemtic Name: methyl 1-acetyloxy-2-(2,6,6-trimethylcyclohexen-1-yl)-2H-pyridine-4-carboxylate Openeye Name: methyl 1-acetoxy-2-(2,6,6-trimethylcyclohexen-1-yl)-2H-pyridine-4-carboxylate CAS Name: 1-acetyloxy-2-(2,6,6-trimethyl-1-cyclohexenyl)-2H-pyridine-4-carboxylic acid methyl ester IUPAC Name: methyl 1-acetyloxy-2-(2,6,6-trimethylcyclohexen-1-yl)-2H-pyridine-4-carboxylate Traditional Name: 1-acetoxy-2-(2,6,6-trimethylcyclohexen-1-yl)-2H-pyridine-4-carboxylic acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C2C=C(C=CN2OC(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(C(CCC1)(C)C)C2C=C(C=CN2OC(=O)C)C(=O)OC

InChI

InChI=1S/C18H25NO4/c1-12-7-6-9-18(3,4)16(12)15-11-14(17(21)22-5)8-10-19(15)23-13(2)20/h8,10-11,15H,6-7,9H2,1-5H3