1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propan-1-one

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propan-1-one Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propan-1-one CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propan-1-one Formula: C19H24ClN5O3 MolecularWeight: 405.87856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24ClN5O3/c1-14-19(25(27)28)15(2)24(21-14)8-7-18(26)23-11-9-22(10-12-23)13-16-3-5-17(20)6-4-16/h3-6H,7-13H2,1-2H3