(4-bromanyl-2-fluoranyl-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H11BrFNO4 MolecularWeight: 380.165243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)OCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)OCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H11BrFNO4/c17-13-6-5-12(15(18)9-13)10-23-16(20)7-4-11-2-1-3-14(8-11)19(21)22/h1-9H,10H2/b7-4+