dimethyl-[1-[[(6-nitro-4-oxidanylidene-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[(6-nitro-4-oxidanylidene-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]ammonium CAS Name: dimethyl-[1-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[(6-nitro-4-oxo-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]azanium Traditional Name: [1-[[(4-keto-6-nitro-1H-quinazolin-7-yl)amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C17H24N5O3+ MolecularWeight: 346.40416

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O3/c1-21(2)17(6-4-3-5-7-17)10-18-14-9-13-12(8-15(14)22(24)25)16(23)20-11-19-13/h8-9,11,18H,3-7,10H2,1-2H3,(H,19,20,23)/p+1