7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]pyridin-3-yl]heptanoic acid

Systemtic Name: 7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]pyridin-3-yl]heptanoic acid Openeye Name: 7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]-3-pyridyl]heptanoic acid CAS Name: 7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]-3-pyridinyl]heptanoic acid IUPAC Name: 7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]pyridin-3-yl]heptanoic acid Traditional Name: 7-[4-[4-[(4-chlorophenyl)sulfonylamino]butyl]-3-pyridyl]enanthic acid Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)NCCCCC2=C(C=NC=C2)CCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)NCCCCC2=C(C=NC=C2)CCCCCCC(=O)O)Cl

InChI

InChI=1S/C22H29ClN2O4S/c23-20-10-12-21(13-11-20)30(28,29)25-15-6-5-7-18-14-16-24-17-19(18)8-3-1-2-4-9-22(26)27/h10-14,16-17,25H,1-9,15H2,(H,26,27)