1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone Openeye Name: 2-(3-isopropylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-2-(3-propan-2-ylphenoxy)ethanone IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(3-propan-2-ylphenoxy)ethanone Traditional Name: 2-(3-isopropylphenoxy)-1-[4-(4-nitrophenyl)piperazino]ethanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-16(2)17-4-3-5-20(14-17)28-15-21(25)23-12-10-22(11-13-23)18-6-8-19(9-7-18)24(26)27/h3-9,14,16H,10-13,15H2,1-2H3