N-(4-methoxyphenyl)-3-[[[4-(methylamino)-3-nitro-phenyl]carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[[[4-(methylamino)-3-nitro-phenyl]carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[[[4-(methylamino)-3-nitro-benzoyl]amino]carbamoyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-[[[[4-(methylamino)-3-nitrophenyl]-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[[[4-(methylamino)-3-nitrobenzoyl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-(4-methoxyphenyl)-3-[[[4-(methylamino)-3-nitro-benzoyl]amino]carbamoyl]benzenesulfonamide Formula: C22H21N5O7S MolecularWeight: 499.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O7S/c1-23-19-11-6-15(13-20(19)27(30)31)22(29)25-24-21(28)14-4-3-5-18(12-14)35(32,33)26-16-7-9-17(34-2)10-8-16/h3-13,23,26H,1-2H3,(H,24,28)(H,25,29)