2-[[4-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoate

Systemtic Name: 2-[[4-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoate Openeye Name: 2-[[4-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl]sulfonylamino]acetate CAS Name: 2-[[4-[(E)-3-[4-(methylthio)phenyl]-1-oxoprop-2-enyl]phenyl]sulfonylamino]acetate IUPAC Name: 2-[[4-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl]sulfonylamino]acetate Traditional Name: 2-[[4-[(E)-3-[4-(methylthio)phenyl]acryloyl]phenyl]sulfonylamino]acetate Formula: C18H16NO5S2- MolecularWeight: 390.45334

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(=O)[O-]

InChI

InChI=1S/C18H17NO5S2/c1-25-15-7-2-13(3-8-15)4-11-17(20)14-5-9-16(10-6-14)26(23,24)19-12-18(21)22/h2-11,19H,12H2,1H3,(H,21,22)/p-1/b11-4+