(3,5-dinitrophenyl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3,5-dinitrophenyl)-[4-(3-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (3,5-dinitrophenyl)-[4-(3-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3,5-dinitrophenyl)-[4-(3-pyridylmethyl)piperazino]methanone Formula: C17H17N5O5 MolecularWeight: 371.34738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O5/c23-17(14-8-15(21(24)25)10-16(9-14)22(26)27)20-6-4-19(5-7-20)12-13-2-1-3-18-11-13/h1-3,8-11H,4-7,12H2