(3-ethoxy-5-methyl-phenyl) phenylmethanesulfonate; 2-(methylideneamino)guanidine

Systemtic Name: (3-ethoxy-5-methyl-phenyl) phenylmethanesulfonate; 2-(methylideneamino)guanidine Openeye Name: (3-ethoxy-5-methyl-phenyl) phenylmethanesulfonate; 2-(methyleneamino)guanidine CAS Name: 2-(methyleneamino)guanidine; phenylmethanesulfonic acid (3-ethoxy-5-methylphenyl) ester IUPAC Name: (3-ethoxy-5-methylphenyl) phenylmethanesulfonate; 2-(methylideneamino)guanidine Traditional Name: 2-(methyleneamino)guanidine; phenylmethanesulfonic acid (3-ethoxy-5-methyl-phenyl) ester Formula: C18H24N4O4S MolecularWeight: 392.47256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C)OS(=O)(=O)CC2=CC=CC=C2.C=NN=C(N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1)C)OS(=O)(=O)CC2=CC=CC=C2.C=NN=C(N)N

InChI

InChI=1S/C16H18O4S.C2H6N4/c1-3-19-15-9-13(2)10-16(11-15)20-21(17,18)12-14-7-5-4-6-8-14;1-5-6-2(3)4/h4-11H,3,12H2,1-2H3;1H2,(H4,3,4,6)