(4-methylpiperidin-1-yl)-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]methanone

Systemtic Name: (4-methylpiperidin-1-yl)-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]methanone Openeye Name: (4-methyl-1-piperidyl)-[3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]phenyl]methanone CAS Name: (4-methyl-1-piperidinyl)-[3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]phenyl]methanone IUPAC Name: (4-methylpiperidin-1-yl)-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]methanone Traditional Name: (4-methylpiperidino)-[3-nitro-4-[4-(2-pyridyl)piperazino]phenyl]methanone Formula: C22H27N5O3 MolecularWeight: 409.48148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H27N5O3/c1-17-7-10-26(11-8-17)22(28)18-5-6-19(20(16-18)27(29)30)24-12-14-25(15-13-24)21-4-2-3-9-23-21/h2-6,9,16-17H,7-8,10-15H2,1H3