(5-bromanylfuran-2-yl)-[7-(phenylmethoxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone

Systemtic Name: (5-bromanylfuran-2-yl)-[7-(phenylmethoxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Openeye Name: [7-(benzyloxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-bromo-2-furyl)methanone CAS Name: (5-bromo-2-furanyl)-[7-(phenylmethoxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone IUPAC Name: (5-bromofuran-2-yl)-[7-(phenylmethoxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Traditional Name: [7-(benzoxymethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-bromo-2-furyl)methanone Formula: C22H20BrNO4 MolecularWeight: 442.3025

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1C(=O)C3=CC=C(O3)Br)C=C(C=C2)COCC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(CN1C(=O)C3=CC=C(O3)Br)C=C(C=C2)COCC4=CC=CC=C4

InChI

InChI=1S/C22H20BrNO4/c23-21-9-8-20(28-21)22(25)24-10-11-27-19-7-6-17(12-18(19)13-24)15-26-14-16-4-2-1-3-5-16/h1-9,12H,10-11,13-15H2