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

Systemtic Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propan-1-one Openeye Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propan-1-one CAS Name: 1-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-3-(5-methyl-3-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-3-(5-methyl-3-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-(4-m-anisylpiperazino)-3-(5-methyl-3-nitro-pyrazol-1-yl)propan-1-one Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O4/c1-15-12-18(24(26)27)20-23(15)7-6-19(25)22-10-8-21(9-11-22)14-16-4-3-5-17(13-16)28-2/h3-5,12-13H,6-11,14H2,1-2H3