[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridinecarboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrrolidinonicotinic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H24N4O4 MolecularWeight: 348.39686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)N2CCCC2

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=C(N=CC=C1)N2CCCC2

InChI

InChI=1S/C17H24N4O4/c1-2-3-8-19-17(24)20-14(22)12-25-16(23)13-7-6-9-18-15(13)21-10-4-5-11-21/h6-7,9H,2-5,8,10-12H2,1H3,(H2,19,20,22,24)