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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CN=CC=C3)[N+](=O)[O-]

InChI

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