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

Systemtic Name: methyl (1R)-5-butanoyl-4-tert-butylimino-2,2-dimethyl-6-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R)-5-butanoyl-4-tert-butylimino-2,2-dimethyl-6-oxo-cyclohexanecarboxylate CAS Name: (1R)-4-tert-butylimino-2,2-dimethyl-6-oxo-5-(1-oxobutyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R)-5-butanoyl-4-tert-butylimino-2,2-dimethyl-6-oxocyclohexane-1-carboxylate Traditional Name: (1R)-4-tert-butylimino-5-butyryl-6-keto-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO4/c1-8-9-12(20)13-11(19-17(2,3)4)10-18(5,6)14(15(13)21)16(22)23-7/h13-14H,8-10H2,1-7H3/t13?,14-/m1/s1