2-[[(E)-3-phenylprop-2-enoyl]amino]propane-1-sulfonic acid

Systemtic Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]propane-1-sulfonic acid Openeye Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]propane-1-sulfonic acid CAS Name: 2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-1-propanesulfonic acid IUPAC Name: 2-[[(E)-3-phenylprop-2-enoyl]amino]propane-1-sulfonic acid Traditional Name: 2-[[(E)-3-phenylacryloyl]amino]propane-1-sulfonic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)O)NC(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CC(CS(=O)(=O)O)NC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C12H15NO4S/c1-10(9-18(15,16)17)13-12(14)8-7-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,13,14)(H,15,16,17)/b8-7+