benzamido-[4-oxidanylidene-4-(2,6,6-trimethylcyclohex-3-en-1-yl)butan-2-yl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: benzamido-[4-oxidanylidene-4-(2,6,6-trimethylcyclohex-3-en-1-yl)butan-2-yl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: benzamido-[1-methyl-3-oxo-3-(2,6,6-trimethylcyclohex-3-en-1-yl)propyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: benzamido-[4-oxo-4-(2,6,6-trimethyl-1-cyclohex-3-enyl)butan-2-yl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: benzamido-[4-oxo-4-(2,6,6-trimethylcyclohex-3-en-1-yl)butan-2-yl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: benzamido-[3-keto-1-methyl-3-(2,6,6-trimethylcyclohex-3-en-1-yl)propyl]ammonium binoxalate Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC(C1C(=O)CC(C)[NH2+]NC(=O)C2=CC=CC=C2)(C)C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1C=CCC(C1C(=O)CC(C)[NH2+]NC(=O)C2=CC=CC=C2)(C)C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C20H28N2O2.C2H2O4/c1-14-9-8-12-20(3,4)18(14)17(23)13-15(2)21-22-19(24)16-10-6-5-7-11-16;3-1(4)2(5)6/h5-11,14-15,18,21H,12-13H2,1-4H3,(H,22,24);(H,3,4)(H,5,6)