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

Systemtic Name: methyl 4-[5-(1,3-benzodioxol-5-yl)-4-phenyl-5H-1,2,4-oxadiazol-3-yl]benzoate Openeye Name: methyl 4-[5-(1,3-benzodioxol-5-yl)-4-phenyl-5H-1,2,4-oxadiazol-3-yl]benzoate CAS Name: 4-[5-(1,3-benzodioxol-5-yl)-4-phenyl-5H-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(1,3-benzodioxol-5-yl)-4-phenyl-5H-1,2,4-oxadiazol-3-yl]benzoate Traditional Name: 4-[5-(1,3-benzodioxol-5-yl)-4-phenyl-5H-1,2,4-oxadiazol-3-yl]benzoic acid methyl ester Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NOC(N2C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NOC(N2C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H18N2O5/c1-27-23(26)16-9-7-15(8-10-16)21-24-30-22(25(21)18-5-3-2-4-6-18)17-11-12-19-20(13-17)29-14-28-19/h2-13,22H,14H2,1H3