4-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]-2-oxidanyl-benzoate

Systemtic Name: 4-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]-2-oxidanyl-benzoate Openeye Name: 4-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]amino]-2-hydroxy-benzoate CAS Name: 4-[[2-[2-(dimethylammonio)ethyl]-4-quinazolinyl]amino]-2-hydroxybenzoate IUPAC Name: 4-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]-2-hydroxybenzoate Traditional Name: 4-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]amino]-2-hydroxy-benzoate Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CCC1=NC2=CC=CC=C2C(=N1)NC3=CC(=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C19H20N4O3/c1-23(2)10-9-17-21-15-6-4-3-5-13(15)18(22-17)20-12-7-8-14(19(25)26)16(24)11-12/h3-8,11,24H,9-10H2,1-2H3,(H,25,26)(H,20,21,22)