2-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(1-phenyl-5-propyl-pyrazol-3-yl)methyl]ethanamine

Systemtic Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(1-phenyl-5-propyl-pyrazol-3-yl)methyl]ethanamine Openeye Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(1-phenyl-5-propyl-pyrazol-3-yl)methyl]ethanamine CAS Name: 2-[4-(4-nitrophenyl)-1-piperazinyl]-N-[(1-phenyl-5-propyl-3-pyrazolyl)methyl]ethanamine IUPAC Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(1-phenyl-5-propylpyrazol-3-yl)methyl]ethanamine Traditional Name: 2-[4-(4-nitrophenyl)piperazino]ethyl-[(1-phenyl-5-propyl-pyrazol-3-yl)methyl]amine Formula: C25H32N6O2 MolecularWeight: 448.56058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NN1C2=CC=CC=C2)CNCCN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=NN1C2=CC=CC=C2)CNCCN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H32N6O2/c1-2-6-25-19-21(27-30(25)23-7-4-3-5-8-23)20-26-13-14-28-15-17-29(18-16-28)22-9-11-24(12-10-22)31(32)33/h3-5,7-12,19,26H,2,6,13-18,20H2,1H3