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

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-azanyl-3-methyl-benzoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-amino-3-methyl-benzoate CAS Name: 2-amino-3-methylbenzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-amino-3-methylbenzoate Traditional Name: 2-amino-3-methyl-benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H14BrN3O3 MolecularWeight: 388.21536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=CC(=C1N)C(=O)OCC2=NC(=NO2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14BrN3O3/c1-10-4-2-7-13(15(10)19)17(22)23-9-14-20-16(21-24-14)11-5-3-6-12(18)8-11/h2-8H,9,19H2,1H3