4-[2-(3-fluoranyl-4-phenylmethoxy-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[2-(3-fluoranyl-4-phenylmethoxy-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[2-(4-benzyloxy-3-fluoro-phenyl)-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-(3-fluoro-4-phenylmethoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-(3-fluoro-4-phenylmethoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-(4-benzoxy-3-fluoro-phenyl)-2-keto-ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C24H18FNO5 MolecularWeight: 419.401823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)F

Isomeric SMILES

C1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)F

InChI

InChI=1S/C24H18FNO5/c25-19-12-17(10-11-22(19)30-14-16-6-2-1-3-7-16)20(27)13-26-23(28)15-31-21-9-5-4-8-18(21)24(26)29/h1-12H,13-15H2