(2R)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]butanedioate

Systemtic Name: (2R)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]butanedioate Openeye Name: (2R)-2-[(6-methoxyquinazolin-4-yl)ammonio]butanedioate CAS Name: (2R)-2-[(6-methoxy-4-quinazolinyl)ammonio]butanedioate IUPAC Name: (2R)-2-[(6-methoxyquinazolin-4-yl)azaniumyl]butanedioate Traditional Name: (2R)-2-[(6-methoxyquinazolin-4-yl)ammonio]succinate Formula: C13H12N3O5- MolecularWeight: 290.25148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2[NH2+]C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2[NH2+][C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H13N3O5/c1-21-7-2-3-9-8(4-7)12(15-6-14-9)16-10(13(19)20)5-11(17)18/h2-4,6,10H,5H2,1H3,(H,17,18)(H,19,20)(H,14,15,16)/p-1/t10-/m1/s1