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

Systemtic Name: (Z)-7-[(1S,2R,3R,4R)-3-[[4-(phenylmethyl)phenyl]sulfonylamino]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid Openeye Name: (Z)-7-[(1S,2R,3R,4R)-3-[(4-benzylphenyl)sulfonylamino]norbornan-2-yl]hept-5-enoic acid CAS Name: (Z)-7-[(1S,2R,3R,4R)-3-[[4-(phenylmethyl)phenyl]sulfonylamino]-2-bicyclo[2.2.1]heptanyl]-5-heptenoic acid IUPAC Name: (Z)-7-[(1S,2R,3R,4R)-3-[(4-benzylphenyl)sulfonylamino]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid Traditional Name: (Z)-7-[(1S,2R,3R,4R)-3-[(4-benzylphenyl)sulfonylamino]norbornan-2-yl]hept-5-enoic acid Formula: C27H33NO4S MolecularWeight: 467.62022

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1C(C2NS(=O)(=O)C3=CC=C(C=C3)CC4=CC=CC=C4)CC=CCCCC(=O)O

Isomeric SMILES

C1C[C@@H]2C[C@H]1[C@H]([C@@H]2NS(=O)(=O)C3=CC=C(C=C3)CC4=CC=CC=C4)C/C=C\CCCC(=O)O

InChI

InChI=1S/C27H33NO4S/c29-26(30)11-7-2-1-6-10-25-22-14-15-23(19-22)27(25)28-33(31,32)24-16-12-21(13-17-24)18-20-8-4-3-5-9-20/h1,3-6,8-9,12-13,16-17,22-23,25,27-28H,2,7,10-11,14-15,18-19H2,(H,29,30)/b6-1-/t22-,23+,25+,27+/m0/s1