4-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-N-(2,4,4-trimethylpentan-2-yl)benzamide

Systemtic Name: 4-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-N-(2,4,4-trimethylpentan-2-yl)benzamide Openeye Name: 4-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N-(1,1,3,3-tetramethylbutyl)benzamide CAS Name: 4-[(2-chloro-5-nitrophenyl)sulfonylamino]-N-(2,4,4-trimethylpentan-2-yl)benzamide IUPAC Name: 4-[(2-chloro-5-nitrophenyl)sulfonylamino]-N-(2,4,4-trimethylpentan-2-yl)benzamide Traditional Name: 4-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N-(1,1,3,3-tetramethylbutyl)benzamide Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H26ClN3O5S/c1-20(2,3)13-21(4,5)23-19(26)14-6-8-15(9-7-14)24-31(29,30)18-12-16(25(27)28)10-11-17(18)22/h6-12,24H,13H2,1-5H3,(H,23,26)