[4-(acetyloxymethyl)-2,6-dimethyl-cyclohexyl] 2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanoate

Systemtic Name: [4-(acetyloxymethyl)-2,6-dimethyl-cyclohexyl] 2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanoate Openeye Name: [4-(acetoxymethyl)-2,6-dimethyl-cyclohexyl] 2-(5-methyl-1H-1,2,4-triazol-3-yl)acetate CAS Name: 2-(5-methyl-1H-1,2,4-triazol-3-yl)acetic acid [4-(acetyloxymethyl)-2,6-dimethylcyclohexyl] ester IUPAC Name: [4-(acetyloxymethyl)-2,6-dimethylcyclohexyl] 2-(5-methyl-1H-1,2,4-triazol-3-yl)acetate Traditional Name: 2-(5-methyl-1H-1,2,4-triazol-3-yl)acetic acid [4-(acetoxymethyl)-2,6-dimethyl-cyclohexyl] ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1OC(=O)CC2=NNC(=N2)C)C)COC(=O)C

Isomeric SMILES

CC1CC(CC(C1OC(=O)CC2=NNC(=N2)C)C)COC(=O)C

InChI

InChI=1S/C16H25N3O4/c1-9-5-13(8-22-12(4)20)6-10(2)16(9)23-15(21)7-14-17-11(3)18-19-14/h9-10,13,16H,5-8H2,1-4H3,(H,17,18,19)