N-(5-bromanylquinolin-8-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(5-bromo-8-quinolyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(5-bromo-8-quinolinyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(5-bromoquinolin-8-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(5-bromo-8-quinolyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C14H10BrN5O4 MolecularWeight: 392.1643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3

InChI

InChI=1S/C14H10BrN5O4/c1-24-14-12(20(22)23)11(18-19-14)13(21)17-9-5-4-8(15)7-3-2-6-16-10(7)9/h2-6H,1H3,(H,17,21)(H,18,19)