methyl 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbonyl-2,3-dihydro-1,4-benzoxazine-7-carboxylate

Systemtic Name: methyl 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbonyl-2,3-dihydro-1,4-benzoxazine-7-carboxylate Openeye Name: methyl 4-(3,5-dichloro-4-hydroxy-benzoyl)-2,3-dihydro-1,4-benzoxazine-7-carboxylate CAS Name: 4-[(3,5-dichloro-4-hydroxyphenyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazine-7-carboxylic acid methyl ester IUPAC Name: methyl 4-(3,5-dichloro-4-hydroxybenzoyl)-2,3-dihydro-1,4-benzoxazine-7-carboxylate Traditional Name: 4-(3,5-dichloro-4-hydroxy-benzoyl)-2,3-dihydro-1,4-benzoxazine-7-carboxylic acid methyl ester Formula: C17H13Cl2NO5 MolecularWeight: 382.19482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(CCO2)C(=O)C3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(CCO2)C(=O)C3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C17H13Cl2NO5/c1-24-17(23)9-2-3-13-14(8-9)25-5-4-20(13)16(22)10-6-11(18)15(21)12(19)7-10/h2-3,6-8,21H,4-5H2,1H3