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

Systemtic Name: N-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(2-chlorobenzyl)piperazino]-4-morpholino-3-nitro-benzamide Formula: C22H26ClN5O4 MolecularWeight: 459.92594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26ClN5O4/c23-19-4-2-1-3-18(19)16-25-7-9-27(10-8-25)24-22(29)17-5-6-20(21(15-17)28(30)31)26-11-13-32-14-12-26/h1-6,15H,7-14,16H2,(H,24,29)