(E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridyl)hept-6-enoic acid CAS Name: (E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (E)-7-[4-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]-7-(3-pyridyl)hept-6-enoic acid Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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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(=C/CCCCC(=O)O)/C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClN2O4S/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/h4-6,8-15,17,19,29H,1-3,7,16,18H2,(H,30,31)/b25-6+