7-chloranyl-2-[[(2-methoxy-2-oxidanylidene-ethyl)-methyl-azaniumyl]methyl]quinazolin-4-olate

Systemtic Name: 7-chloranyl-2-[[(2-methoxy-2-oxidanylidene-ethyl)-methyl-azaniumyl]methyl]quinazolin-4-olate Openeye Name: 7-chloro-2-[[(2-methoxy-2-oxo-ethyl)-methyl-ammonio]methyl]quinazolin-4-olate CAS Name: 7-chloro-2-[[(2-methoxy-2-oxoethyl)-methylammonio]methyl]-4-quinazolinolate IUPAC Name: 7-chloro-2-[[(2-methoxy-2-oxoethyl)-methylazaniumyl]methyl]quinazolin-4-olate Traditional Name: 7-chloro-2-[[(2-keto-2-methoxy-ethyl)-methyl-ammonio]methyl]quinazolin-4-olate Formula: C13H14ClN3O3 MolecularWeight: 295.72156

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC(=O)OC

Isomeric SMILES

C[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC(=O)OC

InChI

InChI=1S/C13H14ClN3O3/c1-17(7-12(18)20-2)6-11-15-10-5-8(14)3-4-9(10)13(19)16-11/h3-5H,6-7H2,1-2H3,(H,15,16,19)