(phenylmethyl) 3-(4-oxidanylidene-3,1-benzoxazin-2-yl)butanoate

Systemtic Name: (phenylmethyl) 3-(4-oxidanylidene-3,1-benzoxazin-2-yl)butanoate Openeye Name: benzyl 3-(4-oxo-3,1-benzoxazin-2-yl)butanoate CAS Name: 3-(4-oxo-3,1-benzoxazin-2-yl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-oxo-3,1-benzoxazin-2-yl)butanoate Traditional Name: 3-(4-keto-3,1-benzoxazin-2-yl)butyric acid benzyl ester Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC1=CC=CC=C1)C2=NC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC(CC(=O)OCC1=CC=CC=C1)C2=NC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C19H17NO4/c1-13(11-17(21)23-12-14-7-3-2-4-8-14)18-20-16-10-6-5-9-15(16)19(22)24-18/h2-10,13H,11-12H2,1H3