2-[1-(2-azanylethyl)pyridin-1-ium-2-yl]-N-phenyl-aniline; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[1-(2-azanylethyl)pyridin-1-ium-2-yl]-N-phenyl-aniline; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[1-(2-aminoethyl)pyridin-1-ium-2-yl]-N-phenyl-aniline; 2-hydroxy-2-oxo-acetate CAS Name: 2-[1-(2-aminoethyl)-2-pyridin-1-iumyl]-N-phenylaniline; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[1-(2-aminoethyl)pyridin-1-ium-2-yl]-N-phenylaniline; 2-hydroxy-2-oxoacetate Traditional Name: [2-[1-(2-aminoethyl)pyridin-1-ium-2-yl]phenyl]-phenyl-amine binoxalate Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=CC=C2C3=CC=CC=[N+]3CCN.C(=O)(C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=CC=C2C3=CC=CC=[N+]3CCN.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C19H19N3.C2H2O4/c20-13-15-22-14-7-6-12-19(22)17-10-4-5-11-18(17)21-16-8-2-1-3-9-16;3-1(4)2(5)6/h1-12,14H,13,15,20H2;(H,3,4)(H,5,6)