[4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[[4-(6-nitro-3-pyridyl)piperazino]methyl]phenyl]-pyrrolidino-methanone Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O3/c27-21(25-9-1-2-10-25)18-5-3-17(4-6-18)16-23-11-13-24(14-12-23)19-7-8-20(22-15-19)26(28)29/h3-8,15H,1-2,9-14,16H2