2-[(3-methoxyphenyl)methyl]guanidine; sulfuric acid

Systemtic Name: 2-[(3-methoxyphenyl)methyl]guanidine; sulfuric acid Openeye Name: 2-[(3-methoxyphenyl)methyl]guanidine; sulfuric acid CAS Name: 2-[(3-methoxyphenyl)methyl]guanidine; sulfuric acid IUPAC Name: 2-[(3-methoxyphenyl)methyl]guanidine; sulfuric acid Traditional Name: 2-m-anisylguanidine; sulfuric acid Formula: C18H28N6O6S MolecularWeight: 456.51652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN=C(N)N.COC1=CC=CC(=C1)CN=C(N)N.OS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)CN=C(N)N.COC1=CC=CC(=C1)CN=C(N)N.OS(=O)(=O)O

InChI

InChI=1S/2C9H13N3O.H2O4S/c2*1-13-8-4-2-3-7(5-8)6-12-9(10)11;1-5(2,3)4/h2*2-5H,6H2,1H3,(H4,10,11,12);(H2,1,2,3,4)