(E)-N-(4-bromanyl-2-fluoranyl-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-bromanyl-2-fluoranyl-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Openeye Name: (E)-N-(4-bromo-2-fluoro-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide CAS Name: (E)-N-(4-bromo-2-fluorophenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propenamide IUPAC Name: (E)-N-(4-bromo-2-fluorophenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Traditional Name: (E)-N-(4-bromo-2-fluoro-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acrylamide Formula: C18H15BrFNO3 MolecularWeight: 392.219003

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C=CC(=O)NC3=C(C=C(C=C3)Br)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)/C=C/C(=O)NC3=C(C=C(C=C3)Br)F)OC1

InChI

InChI=1S/C18H15BrFNO3/c19-13-4-5-15(14(20)11-13)21-18(22)7-3-12-2-6-16-17(10-12)24-9-1-8-23-16/h2-7,10-11H,1,8-9H2,(H,21,22)/b7-3+