methyl 4-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)cyclohexane-1-carboxylate

Systemtic Name: methyl 4-(3-methyl-5-oxidanylidene-1H-1,2,4-triazol-4-yl)cyclohexane-1-carboxylate Openeye Name: methyl 4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)cyclohexanecarboxylate CAS Name: 4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-methyl-5-oxo-1H-1,2,4-triazol-4-yl)cyclohexane-1-carboxylate Traditional Name: 4-(5-keto-3-methyl-1H-1,2,4-triazol-4-yl)cyclohexanecarboxylic acid methyl ester Formula: C11H17N3O3 MolecularWeight: 239.27098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N1C2CCC(CC2)C(=O)OC

Isomeric SMILES

CC1=NNC(=O)N1C2CCC(CC2)C(=O)OC

InChI

InChI=1S/C11H17N3O3/c1-7-12-13-11(16)14(7)9-5-3-8(4-6-9)10(15)17-2/h8-9H,3-6H2,1-2H3,(H,13,16)