(2S)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]pentanoate

Systemtic Name: (2S)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]pentanoate Openeye Name: (2S)-2-[(6-methoxyquinazolin-4-yl)ammonio]pentanoate CAS Name: (2S)-2-[(6-methoxy-4-quinazolinyl)ammonio]pentanoate IUPAC Name: (2S)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]pentanoate Traditional Name: (2S)-2-[(6-methoxyquinazolin-4-yl)ammonio]valerate Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])[NH2+]C1=NC=NC2=C1C=C(C=C2)OC

Isomeric SMILES

CCC[C@@H](C(=O)[O-])[NH2+]C1=NC=NC2=C1C=C(C=C2)OC

InChI

InChI=1S/C14H17N3O3/c1-3-4-12(14(18)19)17-13-10-7-9(20-2)5-6-11(10)15-8-16-13/h5-8,12H,3-4H2,1-2H3,(H,18,19)(H,15,16,17)/t12-/m0/s1