4-(4-ethyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-ethyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-ethyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxo-butanoic acid CAS Name: 4-(4-ethyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxobutanoic acid IUPAC Name: 4-(4-ethyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxobutanoic acid Traditional Name: 4-(4-ethyl-3-keto-2,2-dimethyl-1,4-benzoxazin-6-yl)-4-keto-butyric acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=O)CCC(=O)O)OC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=O)CCC(=O)O)OC(C1=O)(C)C

InChI

InChI=1S/C16H19NO5/c1-4-17-11-9-10(12(18)6-8-14(19)20)5-7-13(11)22-16(2,3)15(17)21/h5,7,9H,4,6,8H2,1-3H3,(H,19,20)