2-methoxy-5-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 2-methoxy-5-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 2-methoxy-5-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 2-methoxy-5-nitro-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 2-methoxy-5-nitro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 2-methoxy-5-nitro-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C19H24N6O4 MolecularWeight: 400.43166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H24N6O4/c1-29-17-5-4-15(25(27)28)14-16(17)18(26)20-8-3-9-23-10-12-24(13-11-23)19-21-6-2-7-22-19/h2,4-7,14H,3,8-13H2,1H3,(H,20,26)