[2-(cyanomethylamino)-2-oxidanylidene-ethyl]-(1-ethoxycarbonylpiperidin-4-yl)azanium

Systemtic Name: [2-(cyanomethylamino)-2-oxidanylidene-ethyl]-(1-ethoxycarbonylpiperidin-4-yl)azanium Openeye Name: [2-(cyanomethylamino)-2-oxo-ethyl]-(1-ethoxycarbonyl-4-piperidyl)ammonium CAS Name: [2-(cyanomethylamino)-2-oxoethyl]-(1-ethoxycarbonyl-4-piperidinyl)ammonium IUPAC Name: [2-(cyanomethylamino)-2-oxoethyl]-(1-ethoxycarbonylpiperidin-4-yl)azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[2-(cyanomethylamino)-2-keto-ethyl]ammonium Formula: C12H21N4O3+ MolecularWeight: 269.32014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]CC(=O)NCC#N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]CC(=O)NCC#N

InChI

InChI=1S/C12H20N4O3/c1-2-19-12(18)16-7-3-10(4-8-16)15-9-11(17)14-6-5-13/h10,15H,2-4,6-9H2,1H3,(H,14,17)/p+1