(E)-10-[3-(phenylsulfonylamino)phenyl]-10-pyridin-3-yl-dec-9-enoic acid

Systemtic Name: (E)-10-[3-(phenylsulfonylamino)phenyl]-10-pyridin-3-yl-dec-9-enoic acid Openeye Name: (E)-10-[3-(benzenesulfonamido)phenyl]-10-(3-pyridyl)dec-9-enoic acid CAS Name: (E)-10-[3-(benzenesulfonamido)phenyl]-10-(3-pyridinyl)-9-decenoic acid IUPAC Name: (E)-10-[3-(benzenesulfonamido)phenyl]-10-pyridin-3-yldec-9-enoic acid Traditional Name: (E)-10-[3-(benzenesulfonamido)phenyl]-10-(3-pyridyl)dec-9-enoic acid Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=CCCCCCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)/C(=C\CCCCCCCC(=O)O)/C3=CN=CC=C3

InChI

InChI=1S/C27H30N2O4S/c30-27(31)18-9-4-2-1-3-8-17-26(23-13-11-19-28-21-23)22-12-10-14-24(20-22)29-34(32,33)25-15-6-5-7-16-25/h5-7,10-17,19-21,29H,1-4,8-9,18H2,(H,30,31)/b26-17+