N-(3-cyanophenyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide

Systemtic Name: N-(3-cyanophenyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide Openeye Name: N-(3-cyanophenyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide CAS Name: N-(3-cyanophenyl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide IUPAC Name: N-(3-cyanophenyl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide Traditional Name: N-(3-cyanophenyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide Formula: C21H16N4O6S MolecularWeight: 452.43994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H16N4O6S/c1-31-20-10-7-17(25(27)28)12-19(20)24-32(29,30)18-8-5-15(6-9-18)21(26)23-16-4-2-3-14(11-16)13-22/h2-12,24H,1H3,(H,23,26)