ethyl-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: ethyl-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: ethyl-[(5-nitro-2-oxo-1-pyridyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: ethyl-[(5-nitro-2-oxo-1-pyridinyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: ethyl-[(5-nitro-2-oxopyridin-1-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: ethyl-[(2-keto-5-nitro-1-pyridyl)methyl]-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C17H18N5O4+ MolecularWeight: 356.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC=CC=C2N1)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c1-2-20(11-21-9-12(22(25)26)7-8-16(21)23)10-15-18-14-6-4-3-5-13(14)17(24)19-15/h3-9H,2,10-11H2,1H3,(H,18,19,24)/p+1