3-chloranylpropyl-[2-(3,4-dimethoxyphenyl)ethylidene]-methyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 3-chloranylpropyl-[2-(3,4-dimethoxyphenyl)ethylidene]-methyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 3-chloropropyl-[2-(3,4-dimethoxyphenyl)ethylidene]-methyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 3-chloropropyl-[2-(3,4-dimethoxyphenyl)ethylidene]-methylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 3-chloropropyl-[2-(3,4-dimethoxyphenyl)ethylidene]-methylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 3-chloropropyl-homoveratrylidene-methyl-ammonium binoxalate Formula: C16H22ClNO6 MolecularWeight: 359.80198

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CCC1=CC(=C(C=C1)OC)OC)CCCCl.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[N+](=CCC1=CC(=C(C=C1)OC)OC)CCCCl.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C14H21ClNO2.C2H2O4/c1-16(9-4-8-15)10-7-12-5-6-13(17-2)14(11-12)18-3;3-1(4)2(5)6/h5-6,10-11H,4,7-9H2,1-3H3;(H,3,4)(H,5,6)/q+1;/p-1