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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O4S.C2H6N4/c1-4-19-14-8-13(3)9-15(11-14)20-21(17,18)16-7-5-6-12(2)10-16;1-5-6-2(3)4/h5-11H,4H2,1-3H3;1H2,(H4,3,4,6)