4-[(2S)-2-carboxylatopyrrolidin-1-yl]quinazoline-7-carboxylate

Systemtic Name: 4-[(2S)-2-carboxylatopyrrolidin-1-yl]quinazoline-7-carboxylate Openeye Name: 4-[(2S)-2-carboxylatopyrrolidin-1-yl]quinazoline-7-carboxylate CAS Name: 4-[(2S)-2-carboxylato-1-pyrrolidinyl]-7-quinazolinecarboxylate IUPAC Name: 4-[(2S)-2-carboxylatopyrrolidin-1-yl]quinazoline-7-carboxylate Traditional Name: 4-[(2S)-2-carboxylatopyrrolidino]quinazoline-7-carboxylate Formula: C14H11N3O4-2 MolecularWeight: 285.25484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=NC3=C2C=CC(=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C[C@H](N(C1)C2=NC=NC3=C2C=CC(=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H13N3O4/c18-13(19)8-3-4-9-10(6-8)15-7-16-12(9)17-5-1-2-11(17)14(20)21/h3-4,6-7,11H,1-2,5H2,(H,18,19)(H,20,21)/p-2/t11-/m0/s1