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

Systemtic Name: (E)-3-(3-bromophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Openeye Name: (E)-3-(3-bromophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide CAS Name: (E)-3-(3-bromophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propenamide IUPAC Name: (E)-3-(3-bromophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Traditional Name: (E)-3-(3-bromophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acrylamide Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)Br)OC1

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrNO3/c19-14-4-1-3-13(11-14)5-8-18(21)20-15-6-7-16-17(12-15)23-10-2-9-22-16/h1,3-8,11-12H,2,9-10H2,(H,20,21)/b8-5+