methyl 1-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]triazole-4-carboxylate CAS Name: 1-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]triazole-4-carboxylate Traditional Name: 1-[4-(piperonyloylamino)phenyl]triazole-4-carboxylic acid methyl ester Formula: C18H14N4O5 MolecularWeight: 366.32756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N4O5/c1-25-18(24)14-9-22(21-20-14)13-5-3-12(4-6-13)19-17(23)11-2-7-15-16(8-11)27-10-26-15/h2-9H,10H2,1H3,(H,19,23)