2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid

Systemtic Name: 2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid Openeye Name: 2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid CAS Name: 2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid IUPAC Name: 2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid Traditional Name: 2-[3-(ethoxymethyl)-5-ethyl-1,2,4-triazol-4-yl]benzoic acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2C(=O)O)COCC

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2C(=O)O)COCC

InChI

InChI=1S/C14H17N3O3/c1-3-12-15-16-13(9-20-4-2)17(12)11-8-6-5-7-10(11)14(18)19/h5-8H,3-4,9H2,1-2H3,(H,18,19)