(5-azanyl-4-benzamido-5-oxidanylidene-pentyl)-[bis(azanyl)methylidene]azanium chloride

Systemtic Name: (5-azanyl-4-benzamido-5-oxidanylidene-pentyl)-[bis(azanyl)methylidene]azanium chloride Openeye Name: (5-amino-4-benzamido-5-oxo-pentyl)-(diaminomethylene)ammonium chloride CAS Name: (5-amino-4-benzamido-5-oxopentyl)-(diaminomethylidene)ammonium chloride IUPAC Name: (5-amino-4-benzamido-5-oxopentyl)-(diaminomethylidene)azanium chloride Traditional Name: (5-amino-4-benzamido-5-keto-pentyl)-(diaminomethylene)ammonium chloride Formula: C13H20ClN5O2 MolecularWeight: 313.7832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCC[NH+]=C(N)N)C(=O)N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CCC[NH+]=C(N)N)C(=O)N.[Cl-]

InChI

InChI=1S/C13H19N5O2.ClH/c14-11(19)10(7-4-8-17-13(15)16)18-12(20)9-5-2-1-3-6-9;/h1-3,5-6,10H,4,7-8H2,(H2,14,19)(H,18,20)(H4,15,16,17);1H