(2S)-2-azanyl-N-[(1R)-1-cyano-2-phenylmethoxy-ethyl]-3-(3-methylphenyl)propanamide

Systemtic Name: (2S)-2-azanyl-N-[(1R)-1-cyano-2-phenylmethoxy-ethyl]-3-(3-methylphenyl)propanamide Openeye Name: (2S)-2-amino-N-[(1R)-2-benzyloxy-1-cyano-ethyl]-3-(m-tolyl)propanamide CAS Name: (2S)-2-amino-N-[(1R)-1-cyano-2-phenylmethoxyethyl]-3-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-amino-N-[(1R)-1-cyano-2-phenylmethoxyethyl]-3-(3-methylphenyl)propanamide Traditional Name: (2S)-2-amino-N-[(1R)-2-benzoxy-1-cyano-ethyl]-3-(m-tolyl)propionamide Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(C(=O)NC(COCC2=CC=CC=C2)C#N)N

Isomeric SMILES

CC1=CC(=CC=C1)C[C@@H](C(=O)N[C@@H](COCC2=CC=CC=C2)C#N)N

InChI

InChI=1S/C20H23N3O2/c1-15-6-5-9-17(10-15)11-19(22)20(24)23-18(12-21)14-25-13-16-7-3-2-4-8-16/h2-10,18-19H,11,13-14,22H2,1H3,(H,23,24)/t18-,19+/m1/s1