N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]-2-methoxy-N-methyl-benzamide

Systemtic Name: N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-3-methyl-1-oxidanylidene-pentan-2-yl]-2-methoxy-N-methyl-benzamide Openeye Name: N-[(1S)-1-[(2S)-2-cyanopyrrolidine-1-carbonyl]-2-methyl-butyl]-2-methoxy-N-methyl-benzamide CAS Name: N-[(2S)-1-[(2S)-2-cyano-1-pyrrolidinyl]-3-methyl-1-oxopentan-2-yl]-2-methoxy-N-methylbenzamide IUPAC Name: N-[(2S)-1-[(2S)-2-cyanopyrrolidin-1-yl]-3-methyl-1-oxopentan-2-yl]-2-methoxy-N-methylbenzamide Traditional Name: N-[(1S)-1-[(2S)-2-cyanopyrrolidine-1-carbonyl]-2-methyl-butyl]-2-methoxy-N-methyl-benzamide Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCC1C#N)N(C)C(=O)C2=CC=CC=C2OC

Isomeric SMILES

CCC(C)[C@@H](C(=O)N1CCC[C@H]1C#N)N(C)C(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C20H27N3O3/c1-5-14(2)18(20(25)23-12-8-9-15(23)13-21)22(3)19(24)16-10-6-7-11-17(16)26-4/h6-7,10-11,14-15,18H,5,8-9,12H2,1-4H3/t14?,15-,18-/m0/s1