methyl (1S)-5-butanoyl-2,2-dimethyl-4-[(2R)-1-oxidanylbutan-2-yl]imino-6-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S)-5-butanoyl-2,2-dimethyl-4-[(2R)-1-oxidanylbutan-2-yl]imino-6-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1S)-5-butanoyl-4-[(1R)-1-(hydroxymethyl)propyl]imino-2,2-dimethyl-6-oxo-cyclohexanecarboxylate CAS Name: (1S)-4-[(2R)-1-hydroxybutan-2-yl]imino-2,2-dimethyl-6-oxo-5-(1-oxobutyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S)-5-butanoyl-4-[(2R)-1-hydroxybutan-2-yl]imino-2,2-dimethyl-6-oxocyclohexane-1-carboxylate Traditional Name: (1S)-5-butyryl-6-keto-2,2-dimethyl-4-[(1R)-1-methylolpropyl]imino-cyclohexanecarboxylic acid methyl ester Formula: C18H29NO5 MolecularWeight: 339.42656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO5/c1-6-8-13(21)14-12(19-11(7-2)10-20)9-18(3,4)15(16(14)22)17(23)24-5/h11,14-15,20H,6-10H2,1-5H3/t11-,14?,15+/m1/s1