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

Systemtic Name: (4-benzamido-5-methoxy-5-oxidanylidene-pentyl)-[bis(azanyl)methylidene]azanium chloride Openeye Name: (4-benzamido-5-methoxy-5-oxo-pentyl)-(diaminomethylene)ammonium chloride CAS Name: (4-benzamido-5-methoxy-5-oxopentyl)-(diaminomethylidene)ammonium chloride IUPAC Name: (4-benzamido-5-methoxy-5-oxopentyl)-(diaminomethylidene)azanium chloride Traditional Name: (4-benzamido-5-keto-5-methoxy-pentyl)-(diaminomethylene)ammonium chloride Formula: C14H21ClN4O3 MolecularWeight: 328.79454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O3.ClH/c1-21-13(20)11(8-5-9-17-14(15)16)18-12(19)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9H2,1H3,(H,18,19)(H4,15,16,17);1H