9-tert-butyl-3-oxidanylidene-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid

Systemtic Name: 9-tert-butyl-3-oxidanylidene-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid Openeye Name: 9-tert-butyl-3-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid CAS Name: 9-tert-butyl-3-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid IUPAC Name: 9-tert-butyl-3-oxo-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid Traditional Name: 9-tert-butyl-3-keto-5H-pyrimido[2,1-c][1,4]benzoxazine-1-carboxylic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC3=NC(=O)C=C(N32)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC3=NC(=O)C=C(N32)C(=O)O

InChI

InChI=1S/C16H16N2O4/c1-16(2,3)9-4-5-12-10(6-9)18-11(15(20)21)7-14(19)17-13(18)8-22-12/h4-7H,8H2,1-3H3,(H,20,21)