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

Systemtic Name: (E)-N-(4-bromanyl-2-methyl-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Openeye Name: (E)-N-(4-bromo-2-methyl-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide CAS Name: (E)-N-(4-bromo-2-methylphenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propenamide IUPAC Name: (E)-N-(4-bromo-2-methylphenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enamide Traditional Name: (E)-N-(4-bromo-2-methyl-phenyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acrylamide Formula: C19H18BrNO3 MolecularWeight: 388.25512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C=CC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)/C=C/C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H18BrNO3/c1-13-11-15(20)5-6-16(13)21-19(22)8-4-14-3-7-17-18(12-14)24-10-2-9-23-17/h3-8,11-12H,2,9-10H2,1H3,(H,21,22)/b8-4+