2-[5-chloranyl-1'-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2,2',5'-tris(oxidanylidene)spiro[indole-3,3'-pyrrolidine]-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-1'-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2,2',5'-tris(oxidanylidene)spiro[indole-3,3'-pyrrolidine]-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-1'-[(3-fluoro-4-methoxy-phenyl)methyl]-2,2',5'-trioxo-spiro[indoline-3,3'-pyrrolidine]-1-yl]acetic acid CAS Name: 2-[5-chloro-1'-[(3-fluoro-4-methoxyphenyl)methyl]-2,2',5'-trioxo-1-spiro[indole-3,3'-pyrrolidine]yl]acetic acid IUPAC Name: 2-[5-chloro-1'-[(3-fluoro-4-methoxyphenyl)methyl]-2,2',5'-trioxospiro[indole-3,3'-pyrrolidine]-1-yl]acetic acid Traditional Name: 2-[5-chloro-1'-(3-fluoro-4-methoxy-benzyl)-2,2',5'-triketo-spiro[indoline-3,3'-pyrrolidine]-1-yl]acetic acid Formula: C21H16ClFN2O6 MolecularWeight: 446.812943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)CC3(C2=O)C4=C(C=CC(=C4)Cl)N(C3=O)CC(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)CC3(C2=O)C4=C(C=CC(=C4)Cl)N(C3=O)CC(=O)O)F

InChI

InChI=1S/C21H16ClFN2O6/c1-31-16-5-2-11(6-14(16)23)9-25-17(26)8-21(20(25)30)13-7-12(22)3-4-15(13)24(19(21)29)10-18(27)28/h2-7H,8-10H2,1H3,(H,27,28)