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

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

Systemtic Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]pentanedioate
Openeye Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]pentanedioate
CAS Name:(2R)-2-[(6,7-dimethoxy-4-quinazolinyl)ammonio]pentanedioate
IUPAC Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]pentanedioate
Traditional Name:(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]glutarate
Formula: C15H16N3O6-
MolecularWeight: 334.30404
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H17N3O6/c1-23-11-5-8-10(6-12(11)24-2)16-7-17-14(8)18-9(15(21)22)3-4-13(19)20/h5-7,9H,3-4H2,1-2H3,(H,19,20)(H,21,22)(H,16,17,18)/p-1/t9-/m1/s1


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