2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]-3-hydroxy-propionic acid Formula: C10H10BrNO4S MolecularWeight: 320.1597

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C=CC(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)Br)/C=C/C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C10H10BrNO4S/c11-8-3-1-6(17-8)2-4-9(14)12-7(5-13)10(15)16/h1-4,7,13H,5H2,(H,12,14)(H,15,16)/b4-2+