[2-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[[6-(isopentylamino)-3-pyridyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[[6-(3-methylbutylamino)-3-pyridinyl]amino]-2-oxoethyl]ammonium IUPAC Name: [2-[[6-(3-methylbutylamino)pyridin-3-yl]amino]-2-oxoethyl]azanium Traditional Name: [2-[[6-(isoamylamino)-3-pyridyl]amino]-2-keto-ethyl]ammonium Formula: C12H21N4O+ MolecularWeight: 237.32134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=C(C=C1)NC(=O)C[NH3+]

Isomeric SMILES

CC(C)CCNC1=NC=C(C=C1)NC(=O)C[NH3+]

InChI

InChI=1S/C12H20N4O/c1-9(2)5-6-14-11-4-3-10(8-15-11)16-12(17)7-13/h3-4,8-9H,5-7,13H2,1-2H3,(H,14,15)(H,16,17)/p+1