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

Systemtic Name: 7-bromanyl-4-[1-(5-fluoranyl-1H-indol-3-yl)propan-2-yl]-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 7-bromo-4-[2-(5-fluoro-1H-indol-3-yl)-1-methyl-ethyl]-2-isopropyl-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 7-bromo-4-[1-(5-fluoro-1H-indol-3-yl)propan-2-yl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 7-bromo-4-[1-(5-fluoro-1H-indol-3-yl)propan-2-yl]-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 7-bromo-4-[2-(5-fluoro-1H-indol-3-yl)-1-methyl-ethyl]-2-isopropyl-3-keto-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C24H24BrFN2O4 MolecularWeight: 503.360763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(C2=C(O1)C=CC(=C2)Br)C(=O)O)C(C)CC3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

CC(C)C1C(=O)N(C(C2=C(O1)C=CC(=C2)Br)C(=O)O)C(C)CC3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C24H24BrFN2O4/c1-12(2)22-23(29)28(21(24(30)31)18-9-15(25)4-7-20(18)32-22)13(3)8-14-11-27-19-6-5-16(26)10-17(14)19/h4-7,9-13,21-22,27H,8H2,1-3H3,(H,30,31)