N-butyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]ethanamide

Systemtic Name: N-butyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]ethanamide Openeye Name: N-butyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]acetamide CAS Name: N-butyl-N-[3-(3-nitro-7-pyrazolo[1,5-a]pyrimidinyl)phenyl]acetamide IUPAC Name: N-butyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]acetamide Traditional Name: N-butyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]acetamide Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCCCN(C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C18H19N5O3/c1-3-4-10-21(13(2)24)15-7-5-6-14(11-15)16-8-9-19-18-17(23(25)26)12-20-22(16)18/h5-9,11-12H,3-4,10H2,1-2H3