2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]-N-(4-nitrophenyl)acetamide CAS Name: 2-[N-(5-isoquinolinylsulfonyl)-4-methoxyanilino]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-(N-isoquinolin-5-ylsulfonyl-4-methoxyanilino)-N-(4-nitrophenyl)acetamide Traditional Name: 2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]-N-(4-nitrophenyl)acetamide Formula: C24H20N4O6S MolecularWeight: 492.5038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C24H20N4O6S/c1-34-21-11-9-19(10-12-21)27(16-24(29)26-18-5-7-20(8-6-18)28(30)31)35(32,33)23-4-2-3-17-15-25-14-13-22(17)23/h2-15H,16H2,1H3,(H,26,29)