1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-2-(1-pyridin-3-ylpropyl)pyrrolidine-2-carboxylate

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-2-(1-pyridin-3-ylpropyl)pyrrolidine-2-carboxylate Openeye Name: 1-(3,3-dimethyl-2-oxo-pentanoyl)-2-[1-(3-pyridyl)propyl]pyrrolidine-2-carboxylate CAS Name: 1-(3,3-dimethyl-1,2-dioxopentyl)-2-[1-(3-pyridinyl)propyl]-2-pyrrolidinecarboxylate IUPAC Name: 1-(3,3-dimethyl-2-oxopentanoyl)-2-(1-pyridin-3-ylpropyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-pentanoyl)-2-[1-(3-pyridyl)propyl]pyrrolidine-2-carboxylate Formula: C20H27N2O4- MolecularWeight: 359.43938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=CC=C1)C2(CCCN2C(=O)C(=O)C(C)(C)CC)C(=O)[O-]

Isomeric SMILES

CCC(C1=CN=CC=C1)C2(CCCN2C(=O)C(=O)C(C)(C)CC)C(=O)[O-]

InChI

InChI=1S/C20H28N2O4/c1-5-15(14-9-7-11-21-13-14)20(18(25)26)10-8-12-22(20)17(24)16(23)19(3,4)6-2/h7,9,11,13,15H,5-6,8,10,12H2,1-4H3,(H,25,26)/p-1