2-[4-(4-nitropyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine

Systemtic Name: 2-[4-(4-nitropyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine Openeye Name: 2-[4-(4-nitropyrazol-1-yl)-1-piperazin-1-yl-butyl]pyrimidine CAS Name: 2-[4-(4-nitro-1-pyrazolyl)-1-(1-piperazinyl)butyl]pyrimidine IUPAC Name: 2-[4-(4-nitropyrazol-1-yl)-1-piperazin-1-ylbutyl]pyrimidine Traditional Name: 2-[4-(4-nitropyrazol-1-yl)-1-piperazino-butyl]pyrimidine Formula: C15H21N7O2 MolecularWeight: 331.37294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(CCCN2C=C(C=N2)[N+](=O)[O-])C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1)C(CCCN2C=C(C=N2)[N+](=O)[O-])C3=NC=CC=N3

InChI

InChI=1S/C15H21N7O2/c23-22(24)13-11-19-21(12-13)8-1-3-14(15-17-4-2-5-18-15)20-9-6-16-7-10-20/h2,4-5,11-12,14,16H,1,3,6-10H2