[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-(phenoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 3-(phenoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(phenoxymethyl)-2-benzofurancarboxylic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(phenoxymethyl)coumarilic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C24H18BrNO5 MolecularWeight: 480.30742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OCC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OCC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H18BrNO5/c25-16-7-6-8-17(13-16)26-22(27)15-30-24(28)23-20(14-29-18-9-2-1-3-10-18)19-11-4-5-12-21(19)31-23/h1-13H,14-15H2,(H,26,27)