4-[[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 4-[[(E)-3-(phenylsulfonyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[[(E)-3-(benzenesulfonyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[[(E)-3-(benzenesulfonyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 4-[[(E)-3-besylacryloyl]amino]butyric acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C=CC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C=C/C(=O)NCCCC(=O)O

InChI

InChI=1S/C13H15NO5S/c15-12(14-9-4-7-13(16)17)8-10-20(18,19)11-5-2-1-3-6-11/h1-3,5-6,8,10H,4,7,9H2,(H,14,15)(H,16,17)/b10-8+