1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-dinitrophenoxy)ethanone

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-dinitrophenoxy)ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-dinitrophenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-(2,5-dinitrophenoxy)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-dinitrophenoxy)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-2-(2,5-dinitrophenoxy)ethanone Formula: C19H19ClN4O6 MolecularWeight: 434.83036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O6/c20-15-3-1-14(2-4-15)12-21-7-9-22(10-8-21)19(25)13-30-18-11-16(23(26)27)5-6-17(18)24(28)29/h1-6,11H,7-10,12-13H2