3-[[2-(4-methoxy-4-oxidanylidene-butanoyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl]amino]propanoic acid

Systemtic Name: 3-[[2-(4-methoxy-4-oxidanylidene-butanoyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl]amino]propanoic acid Openeye Name: 3-[[2-(4-methoxy-4-oxo-butanoyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl]amino]propanoic acid CAS Name: 3-[[2-(4-methoxy-1,4-dioxobutyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl]amino]propanoic acid IUPAC Name: 3-[[2-(4-methoxy-4-oxobutanoyl)-5,5-dimethyl-3-oxocyclohexen-1-yl]amino]propanoic acid Traditional Name: 3-[[3-keto-2-(4-keto-4-methoxy-butanoyl)-5,5-dimethyl-cyclohexen-1-yl]amino]propionic acid Formula: C16H23NO6 MolecularWeight: 325.35692

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NCCC(=O)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NCCC(=O)O)C

InChI

InChI=1S/C16H23NO6/c1-16(2)8-10(17-7-6-13(20)21)15(12(19)9-16)11(18)4-5-14(22)23-3/h17H,4-9H2,1-3H3,(H,20,21)