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

Systemtic Name: 2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Openeye Name: 2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid CAS Name: 2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid IUPAC Name: 2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Traditional Name: 2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=CC=C2C(=O)O)COCC

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=CC=C2C(=O)O)COCC

InChI

InChI=1S/C15H19N3O3/c1-3-7-13-16-17-14(10-21-4-2)18(13)12-9-6-5-8-11(12)15(19)20/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,19,20)