1-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone

Systemtic Name: 1-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone IUPAC Name: 1-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-[4-(4-methoxy-2-nitro-phenyl)piperazino]ethanone Formula: C23H29N3O5 MolecularWeight: 427.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O5/c1-16(2)19-7-5-17(3)13-22(19)31-15-23(27)25-11-9-24(10-12-25)20-8-6-18(30-4)14-21(20)26(28)29/h5-8,13-14,16H,9-12,15H2,1-4H3