3-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]propanoate

Systemtic Name: 3-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]propanoate Openeye Name: 3-[[2-[(dimethylammonio)methyl]quinazolin-4-yl]amino]propanoate CAS Name: 3-[[2-[(dimethylammonio)methyl]-4-quinazolinyl]amino]propanoate IUPAC Name: 3-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]propanoate Traditional Name: 3-[[2-[(dimethylammonio)methyl]quinazolin-4-yl]amino]propionate Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NCCC(=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NCCC(=O)[O-]

InChI

InChI=1S/C14H18N4O2/c1-18(2)9-12-16-11-6-4-3-5-10(11)14(17-12)15-8-7-13(19)20/h3-6H,7-9H2,1-2H3,(H,19,20)(H,15,16,17)