3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide

Systemtic Name: 3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide Openeye Name: 3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide CAS Name: 3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide IUPAC Name: 3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide Traditional Name: 3-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-N-(3-nitrophenyl)benzamide Formula: C18H21N3O7S MolecularWeight: 423.44024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N(CCO)CCO

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N(CCO)CCO

InChI

InChI=1S/C18H21N3O7S/c1-13-5-6-14(11-17(13)29(27,28)20(7-9-22)8-10-23)18(24)19-15-3-2-4-16(12-15)21(25)26/h2-6,11-12,22-23H,7-10H2,1H3,(H,19,24)