[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(ethoxycarbonylamino)benzoate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(ethoxycarbonylamino)benzoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(ethoxycarbonylamino)benzoate CAS Name: 4-(ethoxycarbonylamino)benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-(ethoxycarbonylamino)benzoate Traditional Name: 4-(carbethoxyamino)benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H16BrN3O5 MolecularWeight: 446.25144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H16BrN3O5/c1-2-26-19(25)21-15-8-6-12(7-9-15)18(24)27-11-16-22-17(23-28-16)13-4-3-5-14(20)10-13/h3-10H,2,11H2,1H3,(H,21,25)