3-fluoranyl-N-[6-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[6-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: 3-fluoro-N-[6-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]-3-pyridyl]benzamide CAS Name: 3-fluoro-N-[6-[4-[(3-nitrophenyl)methyl]-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: 3-fluoro-N-[6-[4-[(3-nitrophenyl)methyl]piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: 3-fluoro-N-[6-[4-(3-nitrobenzyl)piperazino]-3-pyridyl]benzamide Formula: C23H22FN5O3 MolecularWeight: 435.450883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)[N+](=O)[O-])C3=NC=C(C=C3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)[N+](=O)[O-])C3=NC=C(C=C3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H22FN5O3/c24-19-5-2-4-18(14-19)23(30)26-20-7-8-22(25-15-20)28-11-9-27(10-12-28)16-17-3-1-6-21(13-17)29(31)32/h1-8,13-15H,9-12,16H2,(H,26,30)