(4-chloranyl-3-nitro-phenyl)-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[4-[(1-methylpyrazol-4-yl)methyl]piperazino]methanone Formula: C16H18ClN5O3 MolecularWeight: 363.79882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H18ClN5O3/c1-19-10-12(9-18-19)11-20-4-6-21(7-5-20)16(23)13-2-3-14(17)15(8-13)22(24)25/h2-3,8-10H,4-7,11H2,1H3