(E)-3-[4-[1-(phenylsulfonylamino)ethyl]phenyl]but-2-enoic acid

Systemtic Name: (E)-3-[4-[1-(phenylsulfonylamino)ethyl]phenyl]but-2-enoic acid Openeye Name: (E)-3-[4-[1-(benzenesulfonamido)ethyl]phenyl]but-2-enoic acid CAS Name: (E)-3-[4-[1-(benzenesulfonamido)ethyl]phenyl]-2-butenoic acid IUPAC Name: (E)-3-[4-[1-(benzenesulfonamido)ethyl]phenyl]but-2-enoic acid Traditional Name: (E)-3-[4-[1-(benzenesulfonamido)ethyl]phenyl]but-2-enoic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=CC(=O)O)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C1=CC=C(C=C1)/C(=C/C(=O)O)/C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO4S/c1-13(12-18(20)21)15-8-10-16(11-9-15)14(2)19-24(22,23)17-6-4-3-5-7-17/h3-12,14,19H,1-2H3,(H,20,21)/b13-12+