N-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]pyridine-3-carboxamide

Systemtic Name: N-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]pyridine-3-carboxamide Openeye Name: N-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]pyridine-3-carboxamide CAS Name: N-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]pyridine-3-carboxamide Traditional Name: N-[[4-(4-nitrophenyl)piperazino]methyl]nicotinamide Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CNC(=O)C2=CN=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CNC(=O)C2=CN=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N5O3/c23-17(14-2-1-7-18-12-14)19-13-20-8-10-21(11-9-20)15-3-5-16(6-4-15)22(24)25/h1-7,12H,8-11,13H2,(H,19,23)