5-chloranyl-N-[(3-nitrophenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-chloranyl-N-[(3-nitrophenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-chloro-N-[(3-nitrophenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-chloro-N-[(3-nitrophenyl)methyl]-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-chloro-N-[(3-nitrophenyl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (5-chloropyrazolo[1,5-a]pyrimidin-7-yl)-(3-nitrobenzyl)amine Formula: C13H10ClN5O2 MolecularWeight: 303.7038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=CC(=NC3=CC=NN32)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=CC(=NC3=CC=NN32)Cl

InChI

InChI=1S/C13H10ClN5O2/c14-11-7-13(18-12(17-11)4-5-16-18)15-8-9-2-1-3-10(6-9)19(20)21/h1-7,15H,8H2