N-(4-butylphenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(4-butylphenyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide CAS Name: N-(4-butylphenyl)-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]acetamide IUPAC Name: N-(4-butylphenyl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)acetamide Traditional Name: N-(4-butylphenyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O7S/c1-2-3-4-17-5-7-18(8-6-17)23-22(26)16-32-21-10-9-19(15-20(21)25(27)28)33(29,30)24-11-13-31-14-12-24/h5-10,15H,2-4,11-14,16H2,1H3,(H,23,26)