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

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

CC(C(=O)O)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)OC

Isomeric SMILES

CC(C(=O)O)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)OC

InChI

InChI=1S/C16H23NO6/c1-9(15(21)22)17-10-7-16(2,3)8-12(19)14(10)11(18)5-6-13(20)23-4/h9,17H,5-8H2,1-4H3,(H,21,22)