(2R)-4-(5-cyanopyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: (2R)-4-(5-cyanopyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: (2R)-4-(5-cyano-2-pyridyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: (2R)-4-(5-cyano-2-pyridinyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: (2R)-4-(5-cyanopyridin-2-yl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: (2R)-4-(5-cyano-2-pyridyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C3=NC=C(C=C3)C#N)C(=O)O

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2N1C3=NC=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C15H11N3O3/c16-7-10-5-6-14(17-8-10)18-9-13(15(19)20)21-12-4-2-1-3-11(12)18/h1-6,8,13H,9H2,(H,19,20)/t13-/m1/s1