1-(3-nitrophenyl)ethyl 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate

Systemtic Name: 1-(3-nitrophenyl)ethyl 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate Openeye Name: 1-(3-nitrophenyl)ethyl 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoate Traditional Name: 5-(dimethylsulfamoyl)-2-(2-hydroxyethylamino)benzoic acid 1-(3-nitrophenyl)ethyl ester Formula: C19H23N3O7S MolecularWeight: 437.46682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)NCCO

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)NCCO

InChI

InChI=1S/C19H23N3O7S/c1-13(14-5-4-6-15(11-14)22(25)26)29-19(24)17-12-16(30(27,28)21(2)3)7-8-18(17)20-9-10-23/h4-8,11-13,20,23H,9-10H2,1-3H3