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

Systemtic Name: 2-[[2-(4-methoxy-4-oxidanylidene-butanoyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl]amino]ethanoic acid Openeye Name: 2-[[2-(4-methoxy-4-oxo-butanoyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl]amino]acetic acid CAS Name: 2-[[2-(4-methoxy-1,4-dioxobutyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl]amino]acetic acid IUPAC Name: 2-[[2-(4-methoxy-4-oxobutanoyl)-5,5-dimethyl-3-oxocyclohexen-1-yl]amino]acetic acid Traditional Name: 2-[[3-keto-2-(4-keto-4-methoxy-butanoyl)-5,5-dimethyl-cyclohexen-1-yl]amino]acetic acid Formula: C15H21NO6 MolecularWeight: 311.33034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO6/c1-15(2)6-9(16-8-12(19)20)14(11(18)7-15)10(17)4-5-13(21)22-3/h16H,4-8H2,1-3H3,(H,19,20)