3-[1-phenyl-2-[4-(phenylsulfonyl)phenyl]-6,7-dihydro-5H-pyrrolizin-3-yl]propanoic acid

Systemtic Name: 3-[1-phenyl-2-[4-(phenylsulfonyl)phenyl]-6,7-dihydro-5H-pyrrolizin-3-yl]propanoic acid Openeye Name: 3-[2-[4-(benzenesulfonyl)phenyl]-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]propanoic acid CAS Name: 3-[2-[4-(benzenesulfonyl)phenyl]-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]propanoic acid IUPAC Name: 3-[2-[4-(benzenesulfonyl)phenyl]-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]propanoic acid Traditional Name: 3-[2-(4-besylphenyl)-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]propionic acid Formula: C28H25NO4S MolecularWeight: 471.5674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=C(N2C1)CCC(=O)O)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C(=C(N2C1)CCC(=O)O)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25NO4S/c30-26(31)18-17-25-28(27(20-8-3-1-4-9-20)24-12-7-19-29(24)25)21-13-15-23(16-14-21)34(32,33)22-10-5-2-6-11-22/h1-6,8-11,13-16H,7,12,17-19H2,(H,30,31)