2-[[(E)-3-(5-chloranylthiophen-2-yl)prop-2-enoyl]amino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(5-chloranylthiophen-2-yl)prop-2-enoyl]amino]-3-oxidanyl-butanoic acid Openeye Name: 2-[[(E)-3-(5-chloro-2-thienyl)prop-2-enoyl]amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(E)-3-(5-chloro-2-thiophenyl)-1-oxoprop-2-enyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[[(E)-3-(5-chlorothiophen-2-yl)prop-2-enoyl]amino]-3-hydroxybutanoic acid Traditional Name: 2-[[(E)-3-(5-chloro-2-thienyl)acryloyl]amino]-3-hydroxy-butyric acid Formula: C11H12ClNO4S MolecularWeight: 289.73528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C=CC1=CC=C(S1)Cl)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)/C=C/C1=CC=C(S1)Cl)O

InChI

InChI=1S/C11H12ClNO4S/c1-6(14)10(11(16)17)13-9(15)5-3-7-2-4-8(12)18-7/h2-6,10,14H,1H3,(H,13,15)(H,16,17)/b5-3+