6-chloranyl-N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[[3-(furan-2-carbonylamino)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[[3-[[2-furanyl(oxo)methyl]amino]phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[[3-(furan-2-carbonylamino)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[3-(2-furoylamino)benzyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C22H19ClN2O5 MolecularWeight: 426.84966

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4)Cl)OC1

InChI

InChI=1S/C22H19ClN2O5/c23-17-11-15(12-19-20(17)30-9-3-8-29-19)21(26)24-13-14-4-1-5-16(10-14)25-22(27)18-6-2-7-28-18/h1-2,4-7,10-12H,3,8-9,13H2,(H,24,26)(H,25,27)