(3-bromophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: (3-bromophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: (3-bromophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid (3-bromobenzyl) ester Formula: C21H14BrNO3 MolecularWeight: 408.24476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H14BrNO3/c22-17-8-4-5-14(11-17)13-25-21(24)16-9-10-19-18(12-16)20(26-23-19)15-6-2-1-3-7-15/h1-12H,13H2