4-bromanyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-bromanyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide CAS Name: 4-bromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-bromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide Traditional Name: 4-bromo-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-pyrrole-2-carboxamide Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=CN3)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CC(=CN3)Br)OC1

InChI

InChI=1S/C14H13BrN2O3/c15-9-6-11(16-8-9)14(18)17-10-2-3-12-13(7-10)20-5-1-4-19-12/h2-3,6-8,16H,1,4-5H2,(H,17,18)