(2-chloranylpyridin-3-yl)-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2-chloranylpyridin-3-yl)-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]methanone Openeye Name: (2-chloro-3-pyridyl)-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]methanone CAS Name: (2-chloro-3-pyridinyl)-[4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-chloropyridin-3-yl)-[4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]methanone Traditional Name: (2-chloro-3-pyridyl)-[4-(4-nitro-3-piperidino-phenyl)piperazino]methanone Formula: C21H24ClN5O3 MolecularWeight: 429.89996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=C(N=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=C(N=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H24ClN5O3/c22-20-17(5-4-8-23-20)21(28)26-13-11-24(12-14-26)16-6-7-18(27(29)30)19(15-16)25-9-2-1-3-10-25/h4-8,15H,1-3,9-14H2