(6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C24H18BrNO6 MolecularWeight: 496.30682

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-])Br

Isomeric SMILES

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)COC(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C24H18BrNO6/c25-20-12-18(14-30-22(27)10-9-16-5-4-8-21(11-16)26(28)29)23-19(13-20)15-31-24(32-23)17-6-2-1-3-7-17/h1-13,24H,14-15H2/b10-9+