N-heptan-2-yl-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-heptan-2-yl-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-(1-methylhexyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-heptan-2-yl-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-heptan-2-yl-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-(1-methylhexyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O5S/c1-3-4-5-7-15(2)21-20(24)16-10-12-17(13-11-16)22-29(27,28)19-9-6-8-18(14-19)23(25)26/h6,8-15,22H,3-5,7H2,1-2H3,(H,21,24)