1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-(2-methoxy-5-nitrophenoxy)ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-methoxy-5-nitrophenoxy)ethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-(2-methoxy-5-nitro-phenoxy)ethanone Formula: C19H20ClN3O5 MolecularWeight: 405.8322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H20ClN3O5/c1-27-17-6-5-16(23(25)26)12-18(17)28-13-19(24)22-9-7-21(8-10-22)15-4-2-3-14(20)11-15/h2-6,11-12H,7-10,13H2,1H3