5-[[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(E)-3-(5-bromanylfuran-2-yl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-[[(E)-3-(5-bromo-2-furyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[(E)-3-(5-bromo-2-furanyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(E)-3-(5-bromofuran-2-yl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[(E)-3-(5-bromo-2-furyl)acryloyl]amino]-2-thenoic acid Formula: C12H8BrNO4S MolecularWeight: 342.16522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)C=CC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=C(OC(=C1)Br)/C=C/C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C12H8BrNO4S/c13-9-4-1-7(18-9)2-5-10(15)14-11-6-3-8(19-11)12(16)17/h1-6H,(H,14,15)(H,16,17)/b5-2+