dimethyl-[3-[2-[4-(4-methylphenyl)-2-propan-2-yl-oxan-4-yl]ethanoylamino]propyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: dimethyl-[3-[2-[4-(4-methylphenyl)-2-propan-2-yl-oxan-4-yl]ethanoylamino]propyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; 3-[[2-[2-isopropyl-4-(p-tolyl)tetrahydropyran-4-yl]acetyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[2-[4-(4-methylphenyl)-2-propan-2-yl-4-oxanyl]-1-oxoethyl]amino]propyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: dimethyl-[3-[[2-[4-(4-methylphenyl)-2-propan-2-yloxan-4-yl]acetyl]amino]propyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: 3-[[2-[2-isopropyl-4-(p-tolyl)tetrahydropyran-4-yl]acetyl]amino]propyl-dimethyl-ammonium binoxalate Formula: C24H38N2O6 MolecularWeight: 450.56832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCOC(C2)C(C)C)CC(=O)NCCC[NH+](C)C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCOC(C2)C(C)C)CC(=O)NCCC[NH+](C)C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H36N2O2.C2H2O4/c1-17(2)20-15-22(11-14-26-20,19-9-7-18(3)8-10-19)16-21(25)23-12-6-13-24(4)5;3-1(4)2(5)6/h7-10,17,20H,6,11-16H2,1-5H3,(H,23,25);(H,3,4)(H,5,6)