methyl 3-butanoyl-6,6-dimethyl-4-(1-oxidanylbutan-2-ylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 3-butanoyl-6,6-dimethyl-4-(1-oxidanylbutan-2-ylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 3-butanoyl-4-[1-(hydroxymethyl)propylamino]-6,6-dimethyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-(1-hydroxybutan-2-ylamino)-6,6-dimethyl-2-oxo-3-(1-oxobutyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-butanoyl-4-(1-hydroxybutan-2-ylamino)-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 3-butyryl-2-keto-6,6-dimethyl-4-(1-methylolpropylamino)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C18H29NO5 MolecularWeight: 339.42656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/h11,15,19-20H,6-10H2,1-5H3