3-[1-(4-methylphenyl)sulfonyl-5-phenylmethoxy-indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-[1-(4-methylphenyl)sulfonyl-5-phenylmethoxy-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[5-benzyloxy-1-(p-tolylsulfonyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-[1-(4-methylphenyl)sulfonyl-5-phenylmethoxy-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-[1-(4-methylphenyl)sulfonyl-5-phenylmethoxyindol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(5-benzoxy-1-tosyl-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C26H20N2O5S MolecularWeight: 472.5124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC(=O)NC5=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC(=O)NC5=O

InChI

InChI=1S/C26H20N2O5S/c1-17-7-10-20(11-8-17)34(31,32)28-15-23(22-14-25(29)27-26(22)30)21-13-19(9-12-24(21)28)33-16-18-5-3-2-4-6-18/h2-15H,16H2,1H3,(H,27,29,30)