(2,5-dimethyl-4-nitro-pyrazol-3-yl)-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2,5-dimethyl-4-nitro-pyrazol-3-yl)-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (2,5-dimethyl-4-nitro-pyrazol-3-yl)-[4-(m-tolylmethyl)piperazin-1-yl]methanone CAS Name: (2,5-dimethyl-4-nitro-3-pyrazolyl)-[4-[(3-methylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2,5-dimethyl-4-nitropyrazol-3-yl)-[4-[(3-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (2,5-dimethyl-4-nitro-pyrazol-3-yl)-[4-(3-methylbenzyl)piperazino]methanone Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=C(C(=NN3C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=C(C(=NN3C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c1-13-5-4-6-15(11-13)12-21-7-9-22(10-8-21)18(24)17-16(23(25)26)14(2)19-20(17)3/h4-6,11H,7-10,12H2,1-3H3