(2S)-4-methyl-2-(4-phenyl-1,2,3-triazol-1-yl)pentanoic acid

Systemtic Name: (2S)-4-methyl-2-(4-phenyl-1,2,3-triazol-1-yl)pentanoic acid Openeye Name: (2S)-4-methyl-2-(4-phenyltriazol-1-yl)pentanoic acid CAS Name: (2S)-4-methyl-2-(4-phenyl-1-triazolyl)pentanoic acid IUPAC Name: (2S)-4-methyl-2-(4-phenyltriazol-1-yl)pentanoic acid Traditional Name: (2S)-4-methyl-2-(4-phenyltriazol-1-yl)valeric acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1C=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)N1C=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C14H17N3O2/c1-10(2)8-13(14(18)19)17-9-12(15-16-17)11-6-4-3-5-7-11/h3-7,9-10,13H,8H2,1-2H3,(H,18,19)/t13-/m0/s1