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

Systemtic Name: methyl (E)-3-(5-bromanyl-2-nitro-thiophen-3-yl)prop-2-enoate Openeye Name: methyl (E)-3-(5-bromo-2-nitro-3-thienyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-nitro-3-thiophenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(5-bromo-2-nitrothiophen-3-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-nitro-3-thienyl)acrylic acid methyl ester Formula: C8H6BrNO4S MolecularWeight: 292.10654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6BrNO4S/c1-14-7(11)3-2-5-4-6(9)15-8(5)10(12)13/h2-4H,1H3/b3-2+