1-(phenylmethyl)-3,4-bis[1-(phenylsulfonyl)indol-2-yl]pyrrole-2,5-dione

Systemtic Name: 1-(phenylmethyl)-3,4-bis[1-(phenylsulfonyl)indol-2-yl]pyrrole-2,5-dione Openeye Name: 3,4-bis[1-(benzenesulfonyl)indol-2-yl]-1-benzyl-pyrrole-2,5-dione CAS Name: 3,4-bis[1-(benzenesulfonyl)-2-indolyl]-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 3,4-bis[1-(benzenesulfonyl)indol-2-yl]-1-benzylpyrrole-2,5-dione Traditional Name: 1-benzyl-3,4-bis(1-besylindol-2-yl)-3-pyrroline-2,5-quinone Formula: C39H27N3O6S2 MolecularWeight: 697.77818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=C(C2=O)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5)C6=CC7=CC=CC=C7N6S(=O)(=O)C8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=C(C2=O)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5)C6=CC7=CC=CC=C7N6S(=O)(=O)C8=CC=CC=C8

InChI

InChI=1S/C39H27N3O6S2/c43-38-36(34-24-28-16-10-12-22-32(28)41(34)49(45,46)30-18-6-2-7-19-30)37(39(44)40(38)26-27-14-4-1-5-15-27)35-25-29-17-11-13-23-33(29)42(35)50(47,48)31-20-8-3-9-21-31/h1-25H,26H2