4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-(2-methoxyphenyl)piperazino]butan-1-one Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C)[N+](=O)[O-]

InChI

InChI=1S/C20H27N5O4/c1-15-20(25(27)28)16(2)24(21-15)10-6-9-19(26)23-13-11-22(12-14-23)17-7-4-5-8-18(17)29-3/h4-5,7-8H,6,9-14H2,1-3H3