2-[(5-chloranyl-2-methoxy-phenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-(2-methylpropyl)ethanamide Openeye Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-isobutyl-acetamide CAS Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-(2-methylpropyl)acetamide IUPAC Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-(2-methylpropyl)acetamide Traditional Name: 2-(5-chloro-2-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-isobutyl-acetamide Formula: C20H24ClN3O6S MolecularWeight: 469.93906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC(C)C)C2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NCC(C)C)C2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H24ClN3O6S/c1-13(2)11-22-20(25)12-23(18-9-15(21)6-8-19(18)30-4)31(28,29)16-7-5-14(3)17(10-16)24(26)27/h5-10,13H,11-12H2,1-4H3,(H,22,25)