N-[4-(4-methylphenoxy)phenyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide

Systemtic Name: N-[4-(4-methylphenoxy)phenyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide Openeye Name: N-[4-(4-methylphenoxy)phenyl]-3-(2-nitro-4-sulfamoyl-anilino)propanamide CAS Name: N-[4-(4-methylphenoxy)phenyl]-3-(2-nitro-4-sulfamoylanilino)propanamide IUPAC Name: N-[4-(4-methylphenoxy)phenyl]-3-(2-nitro-4-sulfamoylanilino)propanamide Traditional Name: N-[4-(4-methylphenoxy)phenyl]-3-(2-nitro-4-sulfamoyl-anilino)propionamide Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCNC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O6S/c1-15-2-6-17(7-3-15)32-18-8-4-16(5-9-18)25-22(27)12-13-24-20-11-10-19(33(23,30)31)14-21(20)26(28)29/h2-11,14,24H,12-13H2,1H3,(H,25,27)(H2,23,30,31)