N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-(4-acetylpiperazino)-3-chloro-phenyl]-2-(2-nitrophenoxy)acetamide Formula: C20H21ClN4O5 MolecularWeight: 432.85754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C20H21ClN4O5/c1-14(26)23-8-10-24(11-9-23)17-7-6-15(12-16(17)21)22-20(27)13-30-19-5-3-2-4-18(19)25(28)29/h2-7,12H,8-11,13H2,1H3,(H,22,27)