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

Systemtic Name: [4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: [4-(3-chloro-4-methyl-phenyl)piperazin-1-yl]-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: [4-(3-chloro-4-methylphenyl)-1-piperazinyl]-(2,5-dimethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: [4-(3-chloro-4-methylphenyl)piperazin-1-yl]-(2,5-dimethyl-4-nitropyrazol-3-yl)methanone Traditional Name: [4-(3-chloro-4-methyl-phenyl)piperazino]-(2,5-dimethyl-4-nitro-pyrazol-3-yl)methanone Formula: C17H20ClN5O3 MolecularWeight: 377.8254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=C(C(=NN3C)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=C(C(=NN3C)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H20ClN5O3/c1-11-4-5-13(10-14(11)18)21-6-8-22(9-7-21)17(24)16-15(23(25)26)12(2)19-20(16)3/h4-5,10H,6-9H2,1-3H3