N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-3,5-dinitro-benzamide Openeye Name: N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-3,5-dinitro-benzamide CAS Name: N-[6-(4-methyl-1-piperazinyl)-3-pyridinyl]-3,5-dinitrobenzamide IUPAC Name: N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]-3,5-dinitrobenzamide Traditional Name: N-[6-(4-methylpiperazino)-3-pyridyl]-3,5-dinitro-benzamide Formula: C17H18N6O5 MolecularWeight: 386.36202

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O5/c1-20-4-6-21(7-5-20)16-3-2-13(11-18-16)19-17(24)12-8-14(22(25)26)10-15(9-12)23(27)28/h2-3,8-11H,4-7H2,1H3,(H,19,24)