(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-phenyltriazole-4-carboxylate CAS Name: 2-phenyl-4-triazolecarboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 2-phenyltriazole-4-carboxylate Traditional Name: 2-phenyltriazole-4-carboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C18H14ClN3O4 MolecularWeight: 371.77446

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C18H14ClN3O4/c19-14-8-12(9-16-17(14)25-7-6-24-16)11-26-18(23)15-10-20-22(21-15)13-4-2-1-3-5-13/h1-5,8-10H,6-7,11H2