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

Systemtic Name: (E)-6-[3-[(4-chlorophenyl)sulfonylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (E)-6-[3-[(4-chlorophenyl)sulfonylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (E)-6-[3-[(4-chlorophenyl)sulfonylamino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (E)-6-[3-[(4-chlorophenyl)sulfonylamino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (E)-6-[3-[(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(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl)C(=CCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

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

InChI

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