(2R)-2-[(6-ethylquinazolin-4-yl)azaniumyl]-3-oxidanyl-propanoate

Systemtic Name: (2R)-2-[(6-ethylquinazolin-4-yl)azaniumyl]-3-oxidanyl-propanoate Openeye Name: (2R)-2-[(6-ethylquinazolin-4-yl)ammonio]-3-hydroxy-propanoate CAS Name: (2R)-2-[(6-ethyl-4-quinazolinyl)ammonio]-3-hydroxypropanoate IUPAC Name: (2R)-2-[(6-ethylquinazolin-4-yl)azaniumyl]-3-hydroxypropanoate Traditional Name: (2R)-2-[(6-ethylquinazolin-4-yl)ammonio]-3-hydroxy-propionate Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2[NH2+]C(CO)C(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2[NH2+][C@H](CO)C(=O)[O-]

InChI

InChI=1S/C13H15N3O3/c1-2-8-3-4-10-9(5-8)12(15-7-14-10)16-11(6-17)13(18)19/h3-5,7,11,17H,2,6H2,1H3,(H,18,19)(H,14,15,16)/t11-/m1/s1