(2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(3,3-dimethyl-2-oxo-pentanoyl)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-N-(3-phenylpropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(3,3-dimethyl-2-oxopentanoyl)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-pentanoyl)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O3/c1-4-21(2,3)18(24)20(26)23-15-9-13-17(23)19(25)22-14-8-12-16-10-6-5-7-11-16/h5-7,10-11,17H,4,8-9,12-15H2,1-3H3,(H,22,25)/t17-/m0/s1