7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-yl-heptanoic acid

Systemtic Name: 7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-yl-heptanoic acid Openeye Name: 7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridyl)heptanoic acid CAS Name: 7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridinyl)heptanoic acid IUPAC Name: 7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-ylheptanoic acid Traditional Name: 7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridyl)enanthic acid Formula: C26H29ClN2O4S MolecularWeight: 501.03746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CCCCCC(=O)O)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(CCCCCC(=O)O)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H29ClN2O4S/c27-23-12-14-24(15-13-23)34(32,33)29-18-16-20-8-10-21(11-9-20)25(22-5-4-17-28-19-22)6-2-1-3-7-26(30)31/h4-5,8-15,17,19,25,29H,1-3,6-7,16,18H2,(H,30,31)