(E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (E)-6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C23H21ClN2O4S MolecularWeight: 456.94184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=CCCCC(=O)O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)/C(=C/CCCC(=O)O)/C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN2O4S/c24-19-9-13-21(14-10-19)31(29,30)26-20-11-7-17(8-12-20)22(5-1-2-6-23(27)28)18-4-3-15-25-16-18/h3-5,7-16,26H,1-2,6H2,(H,27,28)/b22-5+