methyl (2S)-3-methyl-2-[[1-(3-phenylpropyl)-1,2,3-triazol-4-yl]carbonylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[1-(3-phenylpropyl)-1,2,3-triazol-4-yl]carbonylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[1-(3-phenylpropyl)triazole-4-carbonyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[1-(3-phenylpropyl)-4-triazolyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[1-(3-phenylpropyl)triazole-4-carbonyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[1-(3-phenylpropyl)triazole-4-carbonyl]amino]butyric acid methyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CN(N=N1)CCCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=CN(N=N1)CCCC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O3/c1-13(2)16(18(24)25-3)19-17(23)15-12-22(21-20-15)11-7-10-14-8-5-4-6-9-14/h4-6,8-9,12-13,16H,7,10-11H2,1-3H3,(H,19,23)/t16-/m0/s1