(5-nitro-2-piperazin-1-yl-phenyl)-piperidin-1-yl-methanone

Systemtic Name: (5-nitro-2-piperazin-1-yl-phenyl)-piperidin-1-yl-methanone Openeye Name: (5-nitro-2-piperazin-1-yl-phenyl)-(1-piperidyl)methanone CAS Name: [5-nitro-2-(1-piperazinyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: (5-nitro-2-piperazin-1-ylphenyl)-piperidin-1-ylmethanone Traditional Name: (5-nitro-2-piperazino-phenyl)-piperidino-methanone Formula: C16H22N4O3 MolecularWeight: 318.37088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCNCC3

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCNCC3

InChI

InChI=1S/C16H22N4O3/c21-16(19-8-2-1-3-9-19)14-12-13(20(22)23)4-5-15(14)18-10-6-17-7-11-18/h4-5,12,17H,1-3,6-11H2