methyl (2S)-2-[[(2S)-2-azanyl-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[(2S)-2-azanyl-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[(2S)-2-amino-1-cyano-3-phenyl-propyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2S)-2-amino-1-cyano-3-phenylpropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2S)-2-amino-1-cyano-3-phenylpropyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2S)-2-amino-1-cyano-3-phenyl-propyl]amino]-4-methyl-valeric acid methyl ester Formula: C17H25N3O2 MolecularWeight: 303.3993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(C#N)C(CC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(C#N)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C17H25N3O2/c1-12(2)9-15(17(21)22-3)20-16(11-18)14(19)10-13-7-5-4-6-8-13/h4-8,12,14-16,20H,9-10,19H2,1-3H3/t14-,15-,16?/m0/s1