2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethyl-piperidin-1-ium-4-ol; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethyl-piperidin-1-ium-4-ol; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethyl-piperidin-1-ium-4-ol; 2-hydroxy-2-oxo-acetate CAS Name: 2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethyl-4-piperidin-1-iumol; 2-hydroxy-2-oxoacetate IUPAC Name: 2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethylpiperidin-1-ium-4-ol; 2-hydroxy-2-oxoacetate Traditional Name: 2,6-bis(4-dimethylaminophenyl)-4-ethyl-3,5-dimethyl-piperidin-1-ium-4-ol binoxalate Formula: C27H39N3O5 MolecularWeight: 485.61566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C([NH2+]C(C1C)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C)O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCC1(C(C([NH2+]C(C1C)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C)O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C25H37N3O.C2H2O4/c1-8-25(29)17(2)23(19-9-13-21(14-10-19)27(4)5)26-24(18(25)3)20-11-15-22(16-12-20)28(6)7;3-1(4)2(5)6/h9-18,23-24,26,29H,8H2,1-7H3;(H,3,4)(H,5,6)