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

Systemtic Name: methyl 4-[[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[5-(3,4-diethoxyphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)C(=O)OC)OCC

InChI

InChI=1S/C21H21N3O6/c1-4-28-16-11-10-15(12-17(16)29-5-2)19-23-24-21(30-19)22-18(25)13-6-8-14(9-7-13)20(26)27-3/h6-12H,4-5H2,1-3H3,(H,22,24,25)