1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(4-nitrophenyl)piperazine Openeye Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(4-nitrophenyl)piperazine CAS Name: 1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-4-(4-nitrophenyl)piperazine IUPAC Name: 1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-4-(4-nitrophenyl)piperazine Traditional Name: 1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-(4-nitrophenyl)piperazine Formula: C18H25N5O2 MolecularWeight: 343.4234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H25N5O2/c1-4-22-15(3)18(14(2)19-22)13-20-9-11-21(12-10-20)16-5-7-17(8-6-16)23(24)25/h5-8H,4,9-13H2,1-3H3