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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)C[NH+](C)C

Isomeric SMILES

C[C@@H](C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)C[NH+](C)C

InChI

InChI=1S/C14H18N4O2/c1-9(14(19)20)15-13-10-6-4-5-7-11(10)16-12(17-13)8-18(2)3/h4-7,9H,8H2,1-3H3,(H,19,20)(H,15,16,17)/t9-/m0/s1