[4-oxidanylidene-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] 4-chloranylbenzoate

Systemtic Name: [4-oxidanylidene-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] 4-chloranylbenzoate Openeye Name: [4-oxo-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-oxo-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] ester IUPAC Name: [4-oxo-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-keto-2-(trichloromethyl)-2,3-dihydro-1,3-benzoxazin-6-yl] ester Formula: C16H9Cl4NO4 MolecularWeight: 421.05896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=CC3=C(C=C2)OC(NC3=O)C(Cl)(Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=CC3=C(C=C2)OC(NC3=O)C(Cl)(Cl)Cl)Cl

InChI

InChI=1S/C16H9Cl4NO4/c17-9-3-1-8(2-4-9)14(23)24-10-5-6-12-11(7-10)13(22)21-15(25-12)16(18,19)20/h1-7,15H,(H,21,22)