1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-2-(3-methyl-4-nitro-pyrazol-1-yl)ethanone

Systemtic Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-2-(3-methyl-4-nitro-pyrazol-1-yl)ethanone Openeye Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-2-(3-methyl-4-nitro-pyrazol-1-yl)ethanone CAS Name: 1-[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]-2-(3-methyl-4-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-2-(3-methyl-4-nitropyrazol-1-yl)ethanone Traditional Name: 1-(4-m-anisylpiperazino)-2-(3-methyl-4-nitro-pyrazol-1-yl)ethanone Formula: C18H23N5O4 MolecularWeight: 373.40632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CC(=O)N2CCN(CC2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CC(=O)N2CCN(CC2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H23N5O4/c1-14-17(23(25)26)12-22(19-14)13-18(24)21-8-6-20(7-9-21)11-15-4-3-5-16(10-15)27-2/h3-5,10,12H,6-9,11,13H2,1-2H3