N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-nitro-benzamide

Systemtic Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-nitro-benzamide Openeye Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-nitro-benzamide CAS Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)-1-piperazinyl]-2-nitrobenzamide IUPAC Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-nitrobenzamide Traditional Name: N-(4-chlorophenyl)-3-[4-(2-hydroxyethyl)piperazino]-2-nitro-benzamide Formula: C19H21ClN4O4 MolecularWeight: 404.84744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC=CC(=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1CCO)C2=CC=CC(=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN4O4/c20-14-4-6-15(7-5-14)21-19(26)16-2-1-3-17(18(16)24(27)28)23-10-8-22(9-11-23)12-13-25/h1-7,25H,8-13H2,(H,21,26)