(2S)-1-[(2S,5R)-5-(phenylmethoxymethyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(2S,5R)-5-(phenylmethoxymethyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(2S,5R)-5-(benzyloxymethyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[oxo-[(2S,5R)-5-(phenylmethoxymethyl)-2-pyrrolidinyl]methyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(2S,5R)-5-(phenylmethoxymethyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(2S,5R)-5-(benzoxymethyl)prolyl]pyrrolidine-2-carbonitrile Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COCC3=CC=CC=C3)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@@H]2CC[C@@H](N2)COCC3=CC=CC=C3)C#N

InChI

InChI=1S/C18H23N3O2/c19-11-16-7-4-10-21(16)18(22)17-9-8-15(20-17)13-23-12-14-5-2-1-3-6-14/h1-3,5-6,15-17,20H,4,7-10,12-13H2/t15-,16+,17+/m1/s1