2-[[3-(azocan-1-ylmethyl)phenyl]methyl]guanidine sulfate

Systemtic Name: 2-[[3-(azocan-1-ylmethyl)phenyl]methyl]guanidine sulfate Openeye Name: 2-[[3-(azocan-1-ylmethyl)phenyl]methyl]guanidine sulfate CAS Name: 2-[[3-(1-azocanylmethyl)phenyl]methyl]guanidine sulfate IUPAC Name: 2-[[3-(azocan-1-ylmethyl)phenyl]methyl]guanidine sulfate Traditional Name: 2-[3-(azocan-1-ylmethyl)benzyl]guanidine sulfate Formula: C16H26N4O4S-2 MolecularWeight: 370.46704

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC2=CC=CC(=C2)CN=C(N)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1CCCN(CCC1)CC2=CC=CC(=C2)CN=C(N)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C16H26N4.H2O4S/c17-16(18)19-12-14-7-6-8-15(11-14)13-20-9-4-2-1-3-5-10-20;1-5(2,3)4/h6-8,11H,1-5,9-10,12-13H2,(H4,17,18,19);(H2,1,2,3,4)/p-2