2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid

Systemtic Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid Openeye Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid CAS Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid IUPAC Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid Traditional Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanoic acid Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C=NC=N1)(C2=CC=CC=C2OC)C(=O)O

Isomeric SMILES

CCCCC(CN1C=NC=N1)(C2=CC=CC=C2OC)C(=O)O

InChI

InChI=1S/C16H21N3O3/c1-3-4-9-16(15(20)21,10-19-12-17-11-18-19)13-7-5-6-8-14(13)22-2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,20,21)