(2,4-dimethylphenyl)-[1-(3-methyl-5-nitro-imidazol-4-yl)piperidin-4-yl]methanone

Systemtic Name: (2,4-dimethylphenyl)-[1-(3-methyl-5-nitro-imidazol-4-yl)piperidin-4-yl]methanone Openeye Name: (2,4-dimethylphenyl)-[1-(3-methyl-5-nitro-imidazol-4-yl)-4-piperidyl]methanone CAS Name: (2,4-dimethylphenyl)-[1-(3-methyl-5-nitro-4-imidazolyl)-4-piperidinyl]methanone IUPAC Name: (2,4-dimethylphenyl)-[1-(3-methyl-5-nitroimidazol-4-yl)piperidin-4-yl]methanone Traditional Name: (2,4-dimethylphenyl)-[1-(3-methyl-5-nitro-imidazol-4-yl)-4-piperidyl]methanone Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C3=C(N=CN3C)[N+](=O)[O-])C

InChI

InChI=1S/C18H22N4O3/c1-12-4-5-15(13(2)10-12)16(23)14-6-8-21(9-7-14)18-17(22(24)25)19-11-20(18)3/h4-5,10-11,14H,6-9H2,1-3H3