(2-bromanyl-4-butan-2-yl-phenyl) (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (2-bromanyl-4-butan-2-yl-phenyl) (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (2-bromo-4-sec-butyl-phenyl) (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (2-bromo-4-butan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-butan-2-ylphenyl) (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (2-bromo-4-sec-butyl-phenyl) ester Formula: C19H18BrNO4 MolecularWeight: 404.25452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C19H18BrNO4/c1-3-13(2)15-8-9-18(17(20)12-15)25-19(22)10-7-14-5-4-6-16(11-14)21(23)24/h4-13H,3H2,1-2H3/b10-7+