[4-[[5-(azepan-1-yl)pyridin-2-yl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[5-(azepan-1-yl)pyridin-2-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[5-(azepan-1-yl)-2-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[5-(1-azepanyl)-2-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[5-(azepan-1-yl)pyridin-2-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-[[5-(azepan-1-yl)-2-pyridyl]amino]-4-keto-butyl]ammonium Formula: C15H25N4O+ MolecularWeight: 277.3852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CN=C(C=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

C1CCCN(CC1)C2=CN=C(C=C2)NC(=O)CCC[NH3+]

InChI

InChI=1S/C15H24N4O/c16-9-5-6-15(20)18-14-8-7-13(12-17-14)19-10-3-1-2-4-11-19/h7-8,12H,1-6,9-11,16H2,(H,17,18,20)/p+1