methyl 3-(diazanylmethylideneamino)-5-(hydroxymethyl)-4-(methylsulfonylamino)benzoate hydrochloride

Systemtic Name: methyl 3-(diazanylmethylideneamino)-5-(hydroxymethyl)-4-(methylsulfonylamino)benzoate hydrochloride Openeye Name: methyl 3-(hydrazinomethyleneamino)-5-(hydroxymethyl)-4-(methanesulfonamido)benzoate hydrochloride CAS Name: 3-(hydrazinylmethylideneamino)-5-(hydroxymethyl)-4-(methanesulfonamido)benzoic acid methyl ester hydrochloride IUPAC Name: methyl 3-(hydrazinylmethylideneamino)-5-(hydroxymethyl)-4-(methanesulfonamido)benzoate hydrochloride Traditional Name: 3-(hydrazinomethyleneamino)-4-(methanesulfonamido)-5-methylol-benzoic acid methyl ester hydrochloride Formula: C11H17ClN4O5S MolecularWeight: 352.79448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)N=CNN)NS(=O)(=O)C)CO.Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)N=CNN)NS(=O)(=O)C)CO.Cl

InChI

InChI=1S/C11H16N4O5S.ClH/c1-20-11(17)7-3-8(5-16)10(15-21(2,18)19)9(4-7)13-6-14-12;/h3-4,6,15-16H,5,12H2,1-2H3,(H,13,14);1H