3-oxidanyl-2-[[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-oxidanyl-2-[[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]propanoic acid Openeye Name: 2-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[(E)-3-(benzenesulfonyl)-1-oxoprop-2-enyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[(E)-3-besylacryloyl]amino]-3-hydroxy-propionic acid Formula: C12H13NO6S MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C=CC(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C=C/C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C12H13NO6S/c14-8-10(12(16)17)13-11(15)6-7-20(18,19)9-4-2-1-3-5-9/h1-7,10,14H,8H2,(H,13,15)(H,16,17)/b7-6+