N-[(4-chlorophenyl)methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[(4-chlorophenyl)methyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-(4-chlorobenzyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H18ClN3O5S/c1-14-2-11-19(12-20(14)25(27)28)31(29,30)24-18-9-5-16(6-10-18)21(26)23-13-15-3-7-17(22)8-4-15/h2-12,24H,13H2,1H3,(H,23,26)