(3-methyl-4-nitro-phenyl)-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-methyl-4-nitro-phenyl)-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3-methyl-4-nitro-phenyl)-[4-(2-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (3-methyl-4-nitrophenyl)-[4-(2-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-methyl-4-nitrophenyl)-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-methyl-4-nitro-phenyl)-[4-(2-pyridylmethyl)piperazino]methanone Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c1-14-12-15(5-6-17(14)22(24)25)18(23)21-10-8-20(9-11-21)13-16-4-2-3-7-19-16/h2-7,12H,8-11,13H2,1H3