[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(4,6-dimethylpyrimidin-2-yl)piperazino]-(3-nitrophenyl)methanone Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H19N5O3/c1-12-10-13(2)19-17(18-12)21-8-6-20(7-9-21)16(23)14-4-3-5-15(11-14)22(24)25/h3-5,10-11H,6-9H2,1-2H3