2-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-1-oxidanyl-guanidine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-1-oxidanyl-guanidine; 4-methylbenzenesulfonic acid Openeye Name: 2-[(E)-(3,5-dimethoxyphenyl)methyleneamino]-1-hydroxy-guanidine; 4-methylbenzenesulfonic acid CAS Name: 2-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-1-hydroxyguanidine; 4-methylbenzenesulfonic acid IUPAC Name: 2-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-1-hydroxyguanidine; 4-methylbenzenesulfonic acid Traditional Name: 2-[(E)-(3,5-dimethoxybenzylidene)amino]-1-hydroxy-guanidine; tosylic acid Formula: C17H22N4O6S MolecularWeight: 410.44478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=CC(=CC(=C1)C=NN=C(N)NO)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.COC1=CC(=CC(=C1)/C=N/N=C(/N)\NO)OC

InChI

InChI=1S/C10H14N4O3.C7H8O3S/c1-16-8-3-7(4-9(5-8)17-2)6-12-13-10(11)14-15;1-6-2-4-7(5-3-6)11(8,9)10/h3-6,15H,1-2H3,(H3,11,13,14);2-5H,1H3,(H,8,9,10)/b12-6+;