2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 4-(diethylsulfamoyl)benzoate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 4-(diethylsulfamoyl)benzoate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 4-(diethylsulfamoyl)benzoate CAS Name: 4-(diethylsulfamoyl)benzoic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 4-(diethylsulfamoyl)benzoate Traditional Name: 4-(diethylsulfamoyl)benzoic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C17H22N4O6S MolecularWeight: 410.44478

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCN2C(=NC=C2[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCCN2C(=NC=C2[N+](=O)[O-])C

InChI

InChI=1S/C17H22N4O6S/c1-4-19(5-2)28(25,26)15-8-6-14(7-9-15)17(22)27-11-10-20-13(3)18-12-16(20)21(23)24/h6-9,12H,4-5,10-11H2,1-3H3