(Z)-7-[(1S,2R,3R,4R)-3-(dibenzothiophen-2-ylsulfonylamino)-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid

Systemtic Name: (Z)-7-[(1S,2R,3R,4R)-3-(dibenzothiophen-2-ylsulfonylamino)-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid Openeye Name: (Z)-7-[(1S,2R,3R,4R)-3-(dibenzothiophen-2-ylsulfonylamino)norbornan-2-yl]hept-5-enoic acid CAS Name: (Z)-7-[(1S,2R,3R,4R)-3-(2-dibenzothiophenylsulfonylamino)-2-bicyclo[2.2.1]heptanyl]-5-heptenoic acid IUPAC Name: (Z)-7-[(1S,2R,3R,4R)-3-(dibenzothiophen-2-ylsulfonylamino)-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid Traditional Name: (Z)-7-[(1S,2R,3R,4R)-3-(dibenzothiophen-2-ylsulfonylamino)norbornan-2-yl]hept-5-enoic acid Formula: C26H29NO4S2 MolecularWeight: 483.64276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1C(C2NS(=O)(=O)C3=CC4=C(C=C3)SC5=CC=CC=C54)CC=CCCCC(=O)O

Isomeric SMILES

C1C[C@@H]2C[C@H]1[C@H]([C@@H]2NS(=O)(=O)C3=CC4=C(C=C3)SC5=CC=CC=C54)C/C=C\CCCC(=O)O

InChI

InChI=1S/C26H29NO4S2/c28-25(29)10-4-2-1-3-7-20-17-11-12-18(15-17)26(20)27-33(30,31)19-13-14-24-22(16-19)21-8-5-6-9-23(21)32-24/h1,3,5-6,8-9,13-14,16-18,20,26-27H,2,4,7,10-12,15H2,(H,28,29)/b3-1-/t17-,18+,20+,26+/m0/s1