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

Systemtic Name: (E)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-prop-2-enamide Openeye Name: (E)-N-[(5-bromo-2-methoxy-phenyl)methyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-prop-2-enamide CAS Name: (E)-N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-2-propenamide IUPAC Name: (E)-N-[(5-bromo-2-methoxyphenyl)methyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methylprop-2-enamide Traditional Name: (E)-N-(5-bromo-2-methoxy-benzyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-acrylamide Formula: C21H22BrNO4 MolecularWeight: 432.30768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO4/c1-23(14-16-13-17(22)6-8-18(16)25-2)21(24)9-5-15-4-7-19-20(12-15)27-11-3-10-26-19/h4-9,12-13H,3,10-11,14H2,1-2H3/b9-5+