4-[1-(5-fluoranyl-1H-indol-3-yl)propan-2-yl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid

Systemtic Name: 4-[1-(5-fluoranyl-1H-indol-3-yl)propan-2-yl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Openeye Name: 4-[2-(5-fluoro-1H-indol-3-yl)-1-methyl-ethyl]-2-isopropyl-8-methoxy-3-oxo-5H-1,4-benzoxazepine-5-carboxylic acid CAS Name: 4-[1-(5-fluoro-1H-indol-3-yl)propan-2-yl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid IUPAC Name: 4-[1-(5-fluoro-1H-indol-3-yl)propan-2-yl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxylic acid Traditional Name: 4-[2-(5-fluoro-1H-indol-3-yl)-1-methyl-ethyl]-2-isopropyl-3-keto-8-methoxy-5H-1,4-benzoxazepine-5-carboxylic acid Formula: C25H27FN2O5 MolecularWeight: 454.490683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27FN2O5/c1-13(2)23-24(29)28(14(3)9-15-12-27-20-8-5-16(26)10-19(15)20)22(25(30)31)18-7-6-17(32-4)11-21(18)33-23/h5-8,10-14,22-23,27H,9H2,1-4H3,(H,30,31)