(2S)-2-[(6-methylquinazolin-4-yl)azaniumyl]propanoate

Systemtic Name: (2S)-2-[(6-methylquinazolin-4-yl)azaniumyl]propanoate Openeye Name: (2S)-2-[(6-methylquinazolin-4-yl)ammonio]propanoate CAS Name: (2S)-2-[(6-methyl-4-quinazolinyl)ammonio]propanoate IUPAC Name: (2S)-2-[(6-methylquinazolin-4-yl)azaniumyl]propanoate Traditional Name: (2S)-2-[(6-methylquinazolin-4-yl)ammonio]propionate Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN=C2[NH2+]C(C)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN=C2[NH2+][C@@H](C)C(=O)[O-]

InChI

InChI=1S/C12H13N3O2/c1-7-3-4-10-9(5-7)11(14-6-13-10)15-8(2)12(16)17/h3-6,8H,1-2H3,(H,16,17)(H,13,14,15)/t8-/m0/s1