3-[3-(5-chloranyl-2,3-dihydrobenzotriazol-1-yl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 3-[3-(5-chloranyl-2,3-dihydrobenzotriazol-1-yl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 3-[3-(5-chloro-2,3-dihydrobenzotriazol-1-yl)-4-hydroxy-phenyl]propanoic acid CAS Name: 3-[3-(5-chloro-2,3-dihydrobenzotriazol-1-yl)-4-hydroxyphenyl]propanoic acid IUPAC Name: 3-[3-(5-chloro-2,3-dihydrobenzotriazol-1-yl)-4-hydroxyphenyl]propanoic acid Traditional Name: 3-[3-(5-chloro-2,3-dihydrobenzotriazol-1-yl)-4-hydroxy-phenyl]propionic acid Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)O)N2C3=C(C=C(C=C3)Cl)NN2)O

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)O)N2C3=C(C=C(C=C3)Cl)NN2)O

InChI

InChI=1S/C15H14ClN3O3/c16-10-3-4-12-11(8-10)17-18-19(12)13-7-9(1-5-14(13)20)2-6-15(21)22/h1,3-5,7-8,17-18,20H,2,6H2,(H,21,22)