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

Systemtic Name: 7-chloranyl-4-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-chloro-4-[(4-chloro-2-fluoro-phenyl)methyl]-2-isopropyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-chloro-4-[(4-chloro-2-fluorophenyl)methyl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-chloro-4-[(4-chloro-2-fluorophenyl)methyl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-chloro-4-(4-chloro-2-fluoro-benzyl)-2-isopropyl-3-keto-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C20H18Cl2FNO4 MolecularWeight: 426.265623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)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/C20H18Cl2FNO4/c1-10(2)18-19(25)24(9-11-3-4-13(22)8-15(11)23)17(20(26)27)14-7-12(21)5-6-16(14)28-18/h3-8,10,17-18H,9H2,1-2H3,(H,26,27)