[N'-[(3-oxidanylidene-4-propyl-1,4-benzoxazin-7-yl)carbonyl]carbamimidoyl]azanium chloride

Systemtic Name: [N'-[(3-oxidanylidene-4-propyl-1,4-benzoxazin-7-yl)carbonyl]carbamimidoyl]azanium chloride Openeye Name: [N'-(3-oxo-4-propyl-1,4-benzoxazine-7-carbonyl)carbamimidoyl]ammonium chloride CAS Name: [amino-[oxo-(3-oxo-4-propyl-1,4-benzoxazin-7-yl)methyl]iminomethyl]ammonium chloride IUPAC Name: [N'-(3-oxo-4-propyl-1,4-benzoxazine-7-carbonyl)carbamimidoyl]azanium chloride Traditional Name: [N'-(3-keto-4-propyl-1,4-benzoxazine-7-carbonyl)amidino]ammonium chloride Formula: C13H17ClN4O3 MolecularWeight: 312.75208

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=CC(=C2)C(=O)N=C([NH3+])N.[Cl-]

Isomeric SMILES

CCCN1C(=O)COC2=C1C=CC(=C2)C(=O)N=C([NH3+])N.[Cl-]

InChI

InChI=1S/C13H16N4O3.ClH/c1-2-5-17-9-4-3-8(12(19)16-13(14)15)6-10(9)20-7-11(17)18;/h3-4,6H,2,5,7H2,1H3,(H4,14,15,16,19);1H