2-[(2,3-dimethyl-1-benzofuran-7-yl)oxy]-N'-oxidanyl-propanimidamide; methanesulfonic acid; hydrobromide

Systemtic Name: 2-[(2,3-dimethyl-1-benzofuran-7-yl)oxy]-N'-oxidanyl-propanimidamide; methanesulfonic acid; hydrobromide Openeye Name: 2-(2,3-dimethylbenzofuran-7-yl)oxy-N'-hydroxy-propanamidine; methanesulfonic acid; hydrobromide CAS Name: 2-[(2,3-dimethyl-7-benzofuranyl)oxy]-N'-hydroxypropanimidamide; methanesulfonic acid; hydrobromide IUPAC Name: 2-[(2,3-dimethyl-1-benzofuran-7-yl)oxy]-N'-hydroxypropanimidamide; methanesulfonic acid; hydrobromide Traditional Name: 2-(2,3-dimethylbenzofuran-7-yl)oxy-N'-hydroxy-propionamidine; mesylic acid; hydrobromide Formula: C14H21BrN2O6S MolecularWeight: 425.29534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2OC(C)C(=NO)N)C.CS(=O)(=O)O.Br

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2OC(C)/C(=N/O)/N)C.CS(=O)(=O)O.Br

InChI

InChI=1S/C13H16N2O3.CH4O3S.BrH/c1-7-8(2)18-12-10(7)5-4-6-11(12)17-9(3)13(14)15-16;1-5(2,3)4;/h4-6,9,16H,1-3H3,(H2,14,15);1H3,(H,2,3,4);1H