4-(azepan-1-ylsulfonyl)-N-[2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-N-(4-methoxyphenyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-(1,3-diketobenzo[de]isoquinolin-2-yl)ethyl]-N-(4-methoxyphenyl)benzamide Formula: C34H33N3O6S MolecularWeight: 611.70732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCCCCC6

Isomeric SMILES

COC1=CC=C(C=C1)N(CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCCCCC6

InChI

InChI=1S/C34H33N3O6S/c1-43-27-16-14-26(15-17-27)36(22-23-37-33(39)29-10-6-8-24-9-7-11-30(31(24)29)34(37)40)32(38)25-12-18-28(19-13-25)44(41,42)35-20-4-2-3-5-21-35/h6-19H,2-5,20-23H2,1H3