methyl 4-[[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[(5-piperonyl-1,3,4-oxadiazol-2-yl)carbamoyl]benzoic acid methyl ester Formula: C19H15N3O6 MolecularWeight: 381.3389

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H15N3O6/c1-25-18(24)13-5-3-12(4-6-13)17(23)20-19-22-21-16(28-19)9-11-2-7-14-15(8-11)27-10-26-14/h2-8H,9-10H2,1H3,(H,20,22,23)