2-(phenylmethyl)guanidine sulfate

Systemtic Name: 2-(phenylmethyl)guanidine sulfate Openeye Name: 2-benzylguanidine sulfate CAS Name: 2-(phenylmethyl)guanidine sulfate IUPAC Name: 2-benzylguanidine sulfate Traditional Name: 2-benzylguanidine sulfate Formula: C16H22N6O4S-2 MolecularWeight: 394.44868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(N)N.C1=CC=C(C=C1)CN=C(N)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN=C(N)N.C1=CC=C(C=C1)CN=C(N)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C8H11N3.H2O4S/c2*9-8(10)11-6-7-4-2-1-3-5-7;1-5(2,3)4/h2*1-5H,6H2,(H4,9,10,11);(H2,1,2,3,4)/p-2