2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: 2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(6-cyano-2,2-dimethyl-3H-1,4-benzoxazin-4-yl)acetic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C(O1)C=CC(=C2)C#N)CC(=O)O)C

Isomeric SMILES

CC1(CN(C2=C(O1)C=CC(=C2)C#N)CC(=O)O)C

InChI

InChI=1S/C13H14N2O3/c1-13(2)8-15(7-12(16)17)10-5-9(6-14)3-4-11(10)18-13/h3-5H,7-8H2,1-2H3,(H,16,17)