2-(4-chloranyl-2-nitro-phenoxy)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-chloranyl-2-nitro-phenoxy)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-chloro-2-nitro-phenoxy)-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(4-chloro-2-nitrophenoxy)-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-chloro-2-nitrophenoxy)-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-chloro-2-nitro-phenoxy)-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)acetamide Formula: C21H24ClN3O7S MolecularWeight: 497.94916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24ClN3O7S/c1-2-31-19-9-7-16(13-20(19)33(29,30)24-10-4-3-5-11-24)23-21(26)14-32-18-8-6-15(22)12-17(18)25(27)28/h6-9,12-13H,2-5,10-11,14H2,1H3,(H,23,26)