methyl (1R)-4-azanylidene-5-butanoyl-2,2-dimethyl-6-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R)-4-azanylidene-5-butanoyl-2,2-dimethyl-6-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R)-5-butanoyl-4-imino-2,2-dimethyl-6-oxo-cyclohexanecarboxylate CAS Name: (1R)-4-imino-2,2-dimethyl-6-oxo-5-(1-oxobutyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R)-5-butanoyl-4-imino-2,2-dimethyl-6-oxocyclohexane-1-carboxylate Traditional Name: (1R)-5-butyryl-4-imino-6-keto-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=N)CC(C(C1=O)C(=O)OC)(C)C

Isomeric SMILES

CCCC(=O)C1C(=N)CC([C@H](C1=O)C(=O)OC)(C)C

InChI

InChI=1S/C14H21NO4/c1-5-6-9(16)10-8(15)7-14(2,3)11(12(10)17)13(18)19-4/h10-11,15H,5-7H2,1-4H3/t10?,11-/m1/s1