ethyl (E)-3-(5-bromanyl-2-nitro-thiophen-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(5-bromanyl-2-nitro-thiophen-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(5-bromo-2-nitro-3-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-nitro-3-thiophenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(5-bromo-2-nitrothiophen-3-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-nitro-3-thienyl)acrylic acid ethyl ester Formula: C9H8BrNO4S MolecularWeight: 306.13312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(SC(=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/C1=C(SC(=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C9H8BrNO4S/c1-2-15-8(12)4-3-6-5-7(10)16-9(6)11(13)14/h3-5H,2H2,1H3/b4-3+