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

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridinecarboxylic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrrolidinonicotinic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=C(N=CC=C2)N3CCCC3

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=C(N=CC=C2)N3CCCC3

InChI

InChI=1S/C22H27N3O3/c1-2-9-19(17-10-4-3-5-11-17)24-20(26)16-28-22(27)18-12-8-13-23-21(18)25-14-6-7-15-25/h3-5,8,10-13,19H,2,6-7,9,14-16H2,1H3,(H,24,26)