[4-[(4-nitrophenyl)methyl]piperazin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-[(4-nitrophenyl)methyl]piperazin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-[(4-nitrophenyl)methyl]piperazin-1-yl]-(4-pyridyl)methanone CAS Name: [4-[(4-nitrophenyl)methyl]-1-piperazinyl]-pyridin-4-ylmethanone IUPAC Name: [4-[(4-nitrophenyl)methyl]piperazin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(4-nitrobenzyl)piperazino]-(4-pyridyl)methanone Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O3/c22-17(15-5-7-18-8-6-15)20-11-9-19(10-12-20)13-14-1-3-16(4-2-14)21(23)24/h1-8H,9-13H2