1-azanyl-1-(methylideneamino)guanidine; (3-ethoxy-5-methyl-phenyl) 5-chloranyl-2-methoxy-benzenesulfonate

Systemtic Name: 1-azanyl-1-(methylideneamino)guanidine; (3-ethoxy-5-methyl-phenyl) 5-chloranyl-2-methoxy-benzenesulfonate Openeye Name: 1-amino-1-(methyleneamino)guanidine; (3-ethoxy-5-methyl-phenyl) 5-chloro-2-methoxy-benzenesulfonate CAS Name: 1-amino-1-(methyleneamino)guanidine; 5-chloro-2-methoxybenzenesulfonic acid (3-ethoxy-5-methylphenyl) ester IUPAC Name: 1-amino-1-(methylideneamino)guanidine; (3-ethoxy-5-methylphenyl) 5-chloro-2-methoxybenzenesulfonate Traditional Name: 1-amino-1-(methyleneamino)guanidine; 5-chloro-2-methoxy-benzenesulfonic acid (3-ethoxy-5-methyl-phenyl) ester Formula: C18H24ClN5O5S MolecularWeight: 457.93166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClO5S.C2H7N5/c1-4-21-13-7-11(2)8-14(10-13)22-23(18,19)16-9-12(17)5-6-15(16)20-3;1-6-7(5)2(3)4/h5-10H,4H2,1-3H3;1,5H2,(H3,3,4)