1-[(Z)-(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]-1-oxidanyl-guanidine; 4-methylbenzenesulfonic acid

Systemtic Name: 1-[(Z)-(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]-1-oxidanyl-guanidine; 4-methylbenzenesulfonic acid Openeye Name: 1-[(Z)-(2-bromo-4,5-dimethoxy-phenyl)methyleneamino]-1-hydroxy-guanidine; 4-methylbenzenesulfonic acid CAS Name: 1-[(Z)-(2-bromo-4,5-dimethoxyphenyl)methylideneamino]-1-hydroxyguanidine; 4-methylbenzenesulfonic acid IUPAC Name: 1-[(Z)-(2-bromo-4,5-dimethoxyphenyl)methylideneamino]-1-hydroxyguanidine; 4-methylbenzenesulfonic acid Traditional Name: 1-[(Z)-(2-bromo-4,5-dimethoxy-benzylidene)amino]-1-hydroxy-guanidine; tosylic acid Formula: C17H21BrN4O6S MolecularWeight: 489.34084

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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)Br)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)Br)OC

InChI

InChI=1S/C10H13BrN4O3.C7H8O3S/c1-17-8-3-6(5-14-15(16)10(12)13)7(11)4-9(8)18-2;1-6-2-4-7(5-3-6)11(8,9)10/h3-5,16H,1-2H3,(H3,12,13);2-5H,1H3,(H,8,9,10)/b14-5-;