[3-[[6-(butylamino)pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-(butylamino)pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-(butylamino)-3-pyridyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-(butylamino)-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-(butylamino)pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-[[6-(butylamino)-3-pyridyl]amino]-3-keto-propyl]ammonium Formula: C12H21N4O+ MolecularWeight: 237.32134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C=C1)NC(=O)CC[NH3+]

Isomeric SMILES

CCCCNC1=NC=C(C=C1)NC(=O)CC[NH3+]

InChI

InChI=1S/C12H20N4O/c1-2-3-8-14-11-5-4-10(9-15-11)16-12(17)6-7-13/h4-5,9H,2-3,6-8,13H2,1H3,(H,14,15)(H,16,17)/p+1