3-methylbutylcarbamoyl N-(1-cyanopyrrolidin-1-ium-1-yl)carbamate

Systemtic Name: 3-methylbutylcarbamoyl N-(1-cyanopyrrolidin-1-ium-1-yl)carbamate Openeye Name: isopentylcarbamoyl N-(1-cyanopyrrolidin-1-ium-1-yl)carbamate CAS Name: N-(1-cyano-1-pyrrolidin-1-iumyl)carbamic acid [(3-methylbutylamino)-oxomethyl] ester IUPAC Name: 3-methylbutylcarbamoyl N-(1-cyanopyrrolidin-1-ium-1-yl)carbamate Traditional Name: N-(1-cyanopyrrolidin-1-ium-1-yl)carbamic acid isoamylcarbamoyl ester Formula: C12H21N4O3+ MolecularWeight: 269.32014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)OC(=O)N[N+]1(CCCC1)C#N

Isomeric SMILES

CC(C)CCNC(=O)OC(=O)N[N+]1(CCCC1)C#N

InChI

InChI=1S/C12H20N4O3/c1-10(2)5-6-14-11(17)19-12(18)15-16(9-13)7-3-4-8-16/h10H,3-8H2,1-2H3,(H-,14,15,17,18)/p+1