2-[2-(5-methoxy-1-methylsulfonyl-indol-3-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(5-methoxy-1-methylsulfonyl-indol-3-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(5-methoxy-1-methylsulfonyl-indol-3-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(5-methoxy-1-methylsulfonyl-3-indolyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(5-methoxy-1-methylsulfonylindol-3-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(1-mesyl-5-methoxy-indol-3-yl)ethyl]isoindoline-1,3-quinone Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCN3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCN3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C

InChI

InChI=1S/C20H18N2O5S/c1-27-14-7-8-18-17(11-14)13(12-22(18)28(2,25)26)9-10-21-19(23)15-5-3-4-6-16(15)20(21)24/h3-8,11-12H,9-10H2,1-2H3