4-methylbenzenesulfonic acid; 1-oxidanyl-1-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]guanidine

Systemtic Name: 4-methylbenzenesulfonic acid; 1-oxidanyl-1-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]guanidine Openeye Name: 1-hydroxy-1-[(Z)-(2,3,4-trimethoxyphenyl)methyleneamino]guanidine; 4-methylbenzenesulfonic acid CAS Name: 1-hydroxy-1-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]guanidine; 4-methylbenzenesulfonic acid IUPAC Name: 1-hydroxy-1-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]guanidine; 4-methylbenzenesulfonic acid Traditional Name: 1-hydroxy-1-[(Z)-(2,3,4-trimethoxybenzylidene)amino]guanidine; tosylic acid Formula: C18H24N4O7S MolecularWeight: 440.47076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=C(C(=C(C=C1)C=NN(C(=N)N)O)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=C(C(=C(C=C1)/C=N\N(C(=N)N)O)OC)OC

InChI

InChI=1S/C11H16N4O4.C7H8O3S/c1-17-8-5-4-7(6-14-15(16)11(12)13)9(18-2)10(8)19-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-6,16H,1-3H3,(H3,12,13);2-5H,1H3,(H,8,9,10)/b14-6-;