N-[2-(diethylamino)-3-methyl-butyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-[2-(diethylamino)-3-methylbutyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(diethylamino)-3-methylbutyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[2-(diethylamino)-3-methyl-butyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O5S/c1-5-25(6-2)21(16(3)4)15-23-22(27)17-10-12-18(13-11-17)24-32(30,31)20-9-7-8-19(14-20)26(28)29/h7-14,16,21,24H,5-6,15H2,1-4H3,(H,23,27)