2-(1,3-benzodioxol-5-yl)-N-[[4-[4,9-diethoxy-1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]phenyl]methylsulfonyl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[[4-[4,9-diethoxy-1,3-bis(oxidanylidene)benzo[f]isoindol-2-yl]phenyl]methylsulfonyl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[[4-(4,9-diethoxy-1,3-dioxo-benzo[f]isoindol-2-yl)phenyl]methylsulfonyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[4-(4,9-diethoxy-1,3-dioxo-2-benzo[f]isoindolyl)phenyl]methylsulfonyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[[4-(4,9-diethoxy-1,3-dioxobenzo[f]isoindol-2-yl)phenyl]methylsulfonyl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[4-(4,9-diethoxy-1,3-diketo-benz[f]isoindol-2-yl)benzyl]sulfonyl-acetamide Formula: C32H28N2O9S MolecularWeight: 616.63772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C3=CC=CC=C31)OCC)C(=O)N(C2=O)C4=CC=C(C=C4)CS(=O)(=O)NC(=O)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCOC1=C2C(=C(C3=CC=CC=C31)OCC)C(=O)N(C2=O)C4=CC=C(C=C4)CS(=O)(=O)NC(=O)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C32H28N2O9S/c1-3-40-29-22-7-5-6-8-23(22)30(41-4-2)28-27(29)31(36)34(32(28)37)21-12-9-19(10-13-21)17-44(38,39)33-26(35)16-20-11-14-24-25(15-20)43-18-42-24/h5-15H,3-4,16-18H2,1-2H3,(H,33,35)