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

Systemtic Name: N-(3-butoxypropyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-(3-butoxypropyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-(3-butoxypropyl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-(3-butoxypropyl)-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-(3-butoxypropyl)-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O6S/c1-3-4-13-30-14-5-12-22-21(25)17-7-9-18(10-8-17)23-31(28,29)19-11-6-16(2)20(15-19)24(26)27/h6-11,15,23H,3-5,12-14H2,1-2H3,(H,22,25)