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(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]butanedioate

(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]butanedioate

Systemtic Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]butanedioate
Openeye Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]butanedioate
CAS Name:(2R)-2-[(6,7-dimethoxy-4-quinazolinyl)ammonio]butanedioate
IUPAC Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]butanedioate
Traditional Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]succinate
Formula: C14H14N3O6-
MolecularWeight: 320.27746
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)[NH2+]C(CC(=O)[O-])C(=O)[O-])OC


Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)[NH2+][C@H](CC(=O)[O-])C(=O)[O-])OC


InChI

InChI=1S/C14H15N3O6/c1-22-10-3-7-8(4-11(10)23-2)15-6-16-13(7)17-9(14(20)21)5-12(18)19/h3-4,6,9H,5H2,1-2H3,(H,18,19)(H,20,21)(H,15,16,17)/p-1/t9-/m1/s1


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