methyl 3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]-2-nitro-phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylate

Systemtic Name: methyl 3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]-2-nitro-phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylate Openeye Name: methyl 3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]-2-nitro-phenyl]methyl]-5-ethyl-2-propyl-imidazole-4-carboxylate CAS Name: 3-[[4-[2-[[butoxy(oxo)methyl]sulfamoyl]phenyl]-2-nitrophenyl]methyl]-5-ethyl-2-propyl-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]-2-nitrophenyl]methyl]-5-ethyl-2-propylimidazole-4-carboxylate Traditional Name: 3-[4-[2-(butoxycarbonylsulfamoyl)phenyl]-2-nitro-benzyl]-5-ethyl-2-propyl-imidazole-4-carboxylic acid methyl ester Formula: C28H34N4O8S MolecularWeight: 586.65656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)CN3C(=NC(=C3C(=O)OC)CC)CCC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)CN3C(=NC(=C3C(=O)OC)CC)CCC)[N+](=O)[O-]

InChI

InChI=1S/C28H34N4O8S/c1-5-8-16-40-28(34)30-41(37,38)24-13-10-9-12-21(24)19-14-15-20(23(17-19)32(35)36)18-31-25(11-6-2)29-22(7-3)26(31)27(33)39-4/h9-10,12-15,17H,5-8,11,16,18H2,1-4H3,(H,30,34)