7-chloranyl-4-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 7-chloranyl-4-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-chloro-4-[(4-chloro-2-fluoro-phenyl)methyl]-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-chloro-4-[(4-chloro-2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-chloro-4-[(4-chloro-2-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-chloro-4-(4-chloro-2-fluoro-benzyl)-3-keto-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C17H12Cl2FNO4 MolecularWeight: 384.185883

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(C2=C(O1)C=CC(=C2)Cl)C(=O)O)CC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

C1C(=O)N(C(C2=C(O1)C=CC(=C2)Cl)C(=O)O)CC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C17H12Cl2FNO4/c18-10-3-4-14-12(5-10)16(17(23)24)21(15(22)8-25-14)7-9-1-2-11(19)6-13(9)20/h1-6,16H,7-8H2,(H,23,24)