2-benzamido-3-prop-2-enylsulfinyl-propanoic acid

Systemtic Name: 2-benzamido-3-prop-2-enylsulfinyl-propanoic acid Openeye Name: 3-allylsulfinyl-2-benzamido-propanoic acid CAS Name: 2-benzamido-3-prop-2-enylsulfinylpropanoic acid IUPAC Name: 2-benzamido-3-prop-2-enylsulfinylpropanoic acid Traditional Name: 3-allylsulfinyl-2-benzamido-propionic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

C=CCS(=O)CC(C(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

C=CCS(=O)CC(C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H15NO4S/c1-2-8-19(18)9-11(13(16)17)14-12(15)10-6-4-3-5-7-10/h2-7,11H,1,8-9H2,(H,14,15)(H,16,17)