(4-oxidanylidene-2-phenyl-3,1-benzoxazin-7-yl) benzoate

Systemtic Name: (4-oxidanylidene-2-phenyl-3,1-benzoxazin-7-yl) benzoate Openeye Name: (4-oxo-2-phenyl-3,1-benzoxazin-7-yl) benzoate CAS Name: benzoic acid (4-oxo-2-phenyl-3,1-benzoxazin-7-yl) ester IUPAC Name: (4-oxo-2-phenyl-3,1-benzoxazin-7-yl) benzoate Traditional Name: benzoic acid (4-keto-2-phenyl-3,1-benzoxazin-7-yl) ester Formula: C21H13NO4 MolecularWeight: 343.33222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC(=O)C4=CC=CC=C4)C(=O)O2

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)OC(=O)C4=CC=CC=C4)C(=O)O2

InChI

InChI=1S/C21H13NO4/c23-20(15-9-5-2-6-10-15)25-16-11-12-17-18(13-16)22-19(26-21(17)24)14-7-3-1-4-8-14/h1-13H