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

Systemtic Name: 5-chloranyl-2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Openeye Name: 5-chloro-2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid CAS Name: 5-chloro-2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid IUPAC Name: 5-chloro-2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Traditional Name: 5-chloro-2-[3-(ethoxymethyl)-5-propyl-1,2,4-triazol-4-yl]benzoic acid Formula: C15H18ClN3O3 MolecularWeight: 323.77472

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=C(C=C(C=C2)Cl)C(=O)O)COCC

Isomeric SMILES

CCCC1=NN=C(N1C2=C(C=C(C=C2)Cl)C(=O)O)COCC

InChI

InChI=1S/C15H18ClN3O3/c1-3-5-13-17-18-14(9-22-4-2)19(13)12-7-6-10(16)8-11(12)15(20)21/h6-8H,3-5,9H2,1-2H3,(H,20,21)