(2S)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]azaniumyl]propanoate

Systemtic Name: (2S)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]azaniumyl]propanoate Openeye Name: (2S)-2-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]ammonio]propanoate CAS Name: (2S)-2-[[2-[2-(dimethylammonio)ethyl]-4-quinazolinyl]ammonio]propanoate IUPAC Name: (2S)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]azaniumyl]propanoate Traditional Name: (2S)-2-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]ammonio]propionate Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH2+]C1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH2+]C1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

InChI

InChI=1S/C15H20N4O2/c1-10(15(20)21)16-14-11-6-4-5-7-12(11)17-13(18-14)8-9-19(2)3/h4-7,10H,8-9H2,1-3H3,(H,20,21)(H,16,17,18)/p+1/t10-/m0/s1