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

Systemtic Name: N-[(1-tert-butyl-5-propyl-pyrazol-3-yl)methyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine Openeye Name: N-[(1-tert-butyl-5-propyl-pyrazol-3-yl)methyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine CAS Name: N-[(1-tert-butyl-5-propyl-3-pyrazolyl)methyl]-2-[4-(4-nitrophenyl)-1-piperazinyl]ethanamine IUPAC Name: N-[(1-tert-butyl-5-propylpyrazol-3-yl)methyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine Traditional Name: (1-tert-butyl-5-propyl-pyrazol-3-yl)methyl-[2-[4-(4-nitrophenyl)piperazino]ethyl]amine Formula: C23H36N6O2 MolecularWeight: 428.57094

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NN1C(C)(C)C)CNCCN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=NN1C(C)(C)C)CNCCN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H36N6O2/c1-5-6-22-17-19(25-28(22)23(2,3)4)18-24-11-12-26-13-15-27(16-14-26)20-7-9-21(10-8-20)29(30)31/h7-10,17,24H,5-6,11-16,18H2,1-4H3