1,3-benzodioxol-5-yl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)OC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C17H13N3O4/c1-11-16(19-20(18-11)12-5-3-2-4-6-12)17(21)24-13-7-8-14-15(9-13)23-10-22-14/h2-9H,10H2,1H3