4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[1-(3-phenylpropyl)-1,2,3-triazol-4-yl]propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[1-(3-phenylpropyl)-1,2,3-triazol-4-yl]propan-2-yl]amino]pentanoic acid Openeye Name: 2-[[2-hydroxy-2-oxo-1-[[1-(3-phenylpropyl)triazol-4-yl]methyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-hydroxy-1-oxo-3-[1-(3-phenylpropyl)-4-triazolyl]propan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-hydroxy-1-oxo-3-[1-(3-phenylpropyl)triazol-4-yl]propan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-hydroxy-2-keto-1-[[1-(3-phenylpropyl)triazol-4-yl]methyl]ethyl]amino]-4-methyl-valeric acid Formula: C20H28N4O4 MolecularWeight: 388.46072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=CN(N=N1)CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CC1=CN(N=N1)CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H28N4O4/c1-14(2)11-17(19(25)26)21-18(20(27)28)12-16-13-24(23-22-16)10-6-9-15-7-4-3-5-8-15/h3-5,7-8,13-14,17-18,21H,6,9-12H2,1-2H3,(H,25,26)(H,27,28)