2-(4-chloranyl-1-oxidanylidene-isoquinolin-2-yl)-N'-oxidanyl-propanimidamide

Systemtic Name: 2-(4-chloranyl-1-oxidanylidene-isoquinolin-2-yl)-N'-oxidanyl-propanimidamide Openeye Name: 2-(4-chloro-1-oxo-2-isoquinolyl)-N'-hydroxy-propanamidine CAS Name: 2-(4-chloro-1-oxo-2-isoquinolinyl)-N'-hydroxypropanimidamide IUPAC Name: 2-(4-chloro-1-oxoisoquinolin-2-yl)-N'-hydroxypropanimidamide Traditional Name: 2-(4-chloro-1-keto-2-isoquinolyl)-N'-hydroxy-propionamidine Formula: C12H12ClN3O2 MolecularWeight: 265.69558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=NO)N)N1C=C(C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CC(/C(=N/O)/N)N1C=C(C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C12H12ClN3O2/c1-7(11(14)15-18)16-6-10(13)8-4-2-3-5-9(8)12(16)17/h2-7,18H,1H3,(H2,14,15)