3-(4-chloranyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide

Systemtic Name: 3-(4-chloranyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide Openeye Name: 3-(4-chloro-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide CAS Name: 3-(4-chloro-3-nitro-1-pyrazolyl)-N-[3-(1-pyrazolyl)propyl]propanamide IUPAC Name: 3-(4-chloro-3-nitropyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)propanamide Traditional Name: 3-(4-chloro-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)propionamide Formula: C12H15ClN6O3 MolecularWeight: 326.7389

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CCCNC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CN(N=C1)CCCNC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H15ClN6O3/c13-10-9-18(16-12(10)19(21)22)8-3-11(20)14-4-1-6-17-7-2-5-15-17/h2,5,7,9H,1,3-4,6,8H2,(H,14,20)