[4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-piperidin-1-yl-methanone Openeye Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-(1-piperidyl)methanone CAS Name: [4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[(5-methyl-3-nitropyrazol-1-yl)methyl]phenyl]-piperidin-1-ylmethanone Traditional Name: [4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]phenyl]-piperidino-methanone Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c1-13-11-16(21(23)24)18-20(13)12-14-5-7-15(8-6-14)17(22)19-9-3-2-4-10-19/h5-8,11H,2-4,9-10,12H2,1H3