1-[5-(1,4-diazepan-4-ium-1-yl)-5-oxidanylidene-pentyl]pyridin-4-one

Systemtic Name: 1-[5-(1,4-diazepan-4-ium-1-yl)-5-oxidanylidene-pentyl]pyridin-4-one Openeye Name: 1-[5-(1,4-diazepan-4-ium-1-yl)-5-oxo-pentyl]pyridin-4-one CAS Name: 1-[5-(1,4-diazepan-4-ium-1-yl)-5-oxopentyl]-4-pyridinone IUPAC Name: 1-[5-(1,4-diazepan-4-ium-1-yl)-5-oxopentyl]pyridin-4-one Traditional Name: 1-[5-(1,4-diazepan-4-ium-1-yl)-5-keto-pentyl]-4-pyridone Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)CCCCN2C=CC(=O)C=C2

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)CCCCN2C=CC(=O)C=C2

InChI

InChI=1S/C15H23N3O2/c19-14-5-11-17(12-6-14)9-2-1-4-15(20)18-10-3-7-16-8-13-18/h5-6,11-12,16H,1-4,7-10,13H2/p+1