7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonyl-amino]heptanoic acid

Systemtic Name: 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonyl-amino]heptanoic acid Openeye Name: 7-[[(E)-3-(3-hydroxyphenyl)allyl]-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonylamino]heptanoic acid Traditional Name: 7-[[(E)-3-(3-hydroxyphenyl)allyl]-mesyl-amino]enanthic acid Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CC=CC1=CC(=CC=C1)O

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)C/C=C/C1=CC(=CC=C1)O

InChI

InChI=1S/C17H25NO5S/c1-24(22,23)18(12-5-3-2-4-11-17(20)21)13-7-9-15-8-6-10-16(19)14-15/h6-10,14,19H,2-5,11-13H2,1H3,(H,20,21)/b9-7+