2-(4-dodecyl-1,2,3-triazol-1-yl)-2-phenyl-ethanoic acid

Systemtic Name: 2-(4-dodecyl-1,2,3-triazol-1-yl)-2-phenyl-ethanoic acid Openeye Name: 2-(4-dodecyltriazol-1-yl)-2-phenyl-acetic acid CAS Name: 2-(4-dodecyl-1-triazolyl)-2-phenylacetic acid IUPAC Name: 2-(4-dodecyltriazol-1-yl)-2-phenylacetic acid Traditional Name: 2-(4-lauryltriazol-1-yl)-2-phenyl-acetic acid Formula: C22H33N3O2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN(N=N1)C(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CN(N=N1)C(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H33N3O2/c1-2-3-4-5-6-7-8-9-10-14-17-20-18-25(24-23-20)21(22(26)27)19-15-12-11-13-16-19/h11-13,15-16,18,21H,2-10,14,17H2,1H3,(H,26,27)