methyl 4-[[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,2,4-oxadiazol-3-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,2,4-oxadiazol-3-yl]methoxy]benzoate Openeye Name: methyl 4-[[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]benzoate CAS Name: 4-[[5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1,2,4-oxadiazol-3-yl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]benzoate Traditional Name: 4-[[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,2,4-oxadiazol-3-yl]methoxy]benzoic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2=NOC(=N2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC2=NOC(=N2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H19N3O5/c1-27-21(26)15-6-8-17(9-7-15)28-13-18-22-19(29-23-18)20(25)24-11-10-14-4-2-3-5-16(14)12-24/h2-9H,10-13H2,1H3