2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]-N-pyridin-3-ylsulfonyl-ethanamide

Systemtic Name: 2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]-N-pyridin-3-ylsulfonyl-ethanamide Openeye Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]-N-(3-pyridylsulfonyl)acetamide CAS Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]-N-(3-pyridinylsulfonyl)acetamide IUPAC Name: 2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]-N-pyridin-3-ylsulfonylacetamide Traditional Name: 2-[4-(4,9-diethoxy-3-keto-1H-benz[f]isoindol-2-yl)phenyl]-N-(3-pyridylsulfonyl)acetamide Formula: C29H27N3O6S MolecularWeight: 545.60618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)CC(=O)NS(=O)(=O)C5=CN=CC=C5

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)CC(=O)NS(=O)(=O)C5=CN=CC=C5

InChI

InChI=1S/C29H27N3O6S/c1-3-37-27-22-9-5-6-10-23(22)28(38-4-2)26-24(27)18-32(29(26)34)20-13-11-19(12-14-20)16-25(33)31-39(35,36)21-8-7-15-30-17-21/h5-15,17H,3-4,16,18H2,1-2H3,(H,31,33)