7-(4-chlorophenyl)-2-pyridin-3-ylsulfonyl-heptanoic acid

Systemtic Name: 7-(4-chlorophenyl)-2-pyridin-3-ylsulfonyl-heptanoic acid Openeye Name: 7-(4-chlorophenyl)-2-(3-pyridylsulfonyl)heptanoic acid CAS Name: 7-(4-chlorophenyl)-2-(3-pyridinylsulfonyl)heptanoic acid IUPAC Name: 7-(4-chlorophenyl)-2-pyridin-3-ylsulfonylheptanoic acid Traditional Name: 7-(4-chlorophenyl)-2-(3-pyridylsulfonyl)enanthic acid Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)S(=O)(=O)C(CCCCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)S(=O)(=O)C(CCCCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C18H20ClNO4S/c19-15-10-8-14(9-11-15)5-2-1-3-7-17(18(21)22)25(23,24)16-6-4-12-20-13-16/h4,6,8-13,17H,1-3,5,7H2,(H,21,22)