[(4-chlorophenyl)-phenyl-methyl]-[2-(propylazaniumyl)ethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [(4-chlorophenyl)-phenyl-methyl]-[2-(propylazaniumyl)ethyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [(4-chlorophenyl)-phenyl-methyl]-[2-(propylammonio)ethyl]ammonium; 2-hydroxy-2-oxo-acetate CAS Name: [(4-chlorophenyl)-phenylmethyl]-[2-(propylammonio)ethyl]ammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [(4-chlorophenyl)-phenylmethyl]-[2-(propylazaniumyl)ethyl]azanium; 2-hydroxy-2-oxoacetate Traditional Name: [(4-chlorophenyl)-phenyl-methyl]-[2-(propylammonio)ethyl]ammonium dibinoxalate Formula: C22H27ClN2O8 MolecularWeight: 482.91138

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC[NH2+]C(C1=CC=CC=C1)C2=CC=C(C=C2)Cl.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCC[NH2+]CC[NH2+]C(C1=CC=CC=C1)C2=CC=C(C=C2)Cl.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H23ClN2.2C2H2O4/c1-2-12-20-13-14-21-18(15-6-4-3-5-7-15)16-8-10-17(19)11-9-16;2*3-1(4)2(5)6/h3-11,18,20-21H,2,12-14H2,1H3;2*(H,3,4)(H,5,6)