1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione Openeye Name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(3-pyridyloxymethyl)pyrrolidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 1-[(4-methoxyphenyl)methyl]-5-[[(2S)-2-(3-pyridinyloxymethyl)-1-pyrrolidinyl]sulfonyl]indole-2,3-dione IUPAC Name: 1-[(4-methoxyphenyl)methyl]-5-[(2S)-2-(pyridin-3-yloxymethyl)pyrrolidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-p-anisyl-5-[(2S)-2-(3-pyridyloxymethyl)pyrrolidino]sulfonyl-isatin Formula: C26H25N3O6S MolecularWeight: 507.5582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4COC5=CN=CC=C5)C(=O)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC[C@H]4COC5=CN=CC=C5)C(=O)C2=O

InChI

InChI=1S/C26H25N3O6S/c1-34-20-8-6-18(7-9-20)16-28-24-11-10-22(14-23(24)25(30)26(28)31)36(32,33)29-13-3-4-19(29)17-35-21-5-2-12-27-15-21/h2,5-12,14-15,19H,3-4,13,16-17H2,1H3/t19-/m0/s1