methyl (2S)-2-[2-cyanoethanoyl(decyl)amino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[2-cyanoethanoyl(decyl)amino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(2-cyanoacetyl)-decyl-amino]-4-methyl-pentanoate CAS Name: (2S)-2-[(2-cyano-1-oxoethyl)-decylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-cyanoacetyl)-decylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(2-cyanoacetyl)-decyl-amino]-4-methyl-valeric acid methyl ester Formula: C20H36N2O3 MolecularWeight: 352.51144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(C(CC(C)C)C(=O)OC)C(=O)CC#N

Isomeric SMILES

CCCCCCCCCCN([C@@H](CC(C)C)C(=O)OC)C(=O)CC#N

InChI

InChI=1S/C20H36N2O3/c1-5-6-7-8-9-10-11-12-15-22(19(23)13-14-21)18(16-17(2)3)20(24)25-4/h17-18H,5-13,15-16H2,1-4H3/t18-/m0/s1