hydrogen carbonate; (phenylmethyl)-[2-[(phenylmethyl)azaniumyl]ethyl]azanium

Systemtic Name: hydrogen carbonate; (phenylmethyl)-[2-[(phenylmethyl)azaniumyl]ethyl]azanium Openeye Name: benzyl-[2-(benzylammonio)ethyl]ammonium; hydrogen carbonate CAS Name: hydrogen carbonate; (phenylmethyl)-[2-[(phenylmethyl)ammonio]ethyl]ammonium IUPAC Name: benzyl-[2-(benzylazaniumyl)ethyl]azanium; hydrogen carbonate Traditional Name: benzyl-[2-(benzylammonio)ethyl]ammonium dibicarbonate Formula: C18H24N2O6 MolecularWeight: 364.39296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CC[NH2+]CC2=CC=CC=C2.C(=O)(O)[O-].C(=O)(O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CC[NH2+]CC2=CC=CC=C2.C(=O)(O)[O-].C(=O)(O)[O-]

InChI

InChI=1S/C16H20N2.2CH2O3/c1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16;2*2-1(3)4/h1-10,17-18H,11-14H2;2*(H2,2,3,4)