N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[[5-(4-bromophenyl)-2-furanyl]methyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-1-keto-isochroman-3-carboxamide Formula: C21H16BrNO4 MolecularWeight: 426.26004

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NCC3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C(OC(=O)C2=CC=CC=C21)C(=O)NCC3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrNO4/c22-15-7-5-13(6-8-15)18-10-9-16(26-18)12-23-20(24)19-11-14-3-1-2-4-17(14)21(25)27-19/h1-10,19H,11-12H2,(H,23,24)