(2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenyl-methoxy]-4-methyl-pentanamide

Systemtic Name: (2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenyl-methoxy]-4-methyl-pentanamide Openeye Name: (2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenyl-methoxy]-4-methyl-pentanamide CAS Name: (2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenylmethoxy]-4-methylpentanamide IUPAC Name: (2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenylmethoxy]-4-methylpentanamide Traditional Name: (2S)-N-(cyanomethyl)-2-[(R)-(4-cyanophenyl)-phenyl-methoxy]-4-methyl-valeramide Formula: C22H23N3O2 MolecularWeight: 361.43692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)OC(C1=CC=CC=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC#N)O[C@H](C1=CC=CC=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H23N3O2/c1-16(2)14-20(22(26)25-13-12-23)27-21(18-6-4-3-5-7-18)19-10-8-17(15-24)9-11-19/h3-11,16,20-21H,13-14H2,1-2H3,(H,25,26)/t20-,21+/m0/s1