(phenylmethyl) (2S)-1-[3-(dimethylamino)-3-oxidanylidene-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[3-(dimethylamino)-3-oxidanylidene-propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[3-(dimethylamino)-3-oxo-propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[3-(dimethylamino)-1,3-dioxopropyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[3-(dimethylamino)-3-oxopropanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[3-(dimethylamino)-3-keto-propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC(=O)N1CCCC1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN(C)C(=O)CC(=O)N1CCC[C@H]1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O4/c1-18(2)15(20)11-16(21)19-10-6-9-14(19)17(22)23-12-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3/t14-/m0/s1