1-[7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxy-ethanone

Systemtic Name: 1-[7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxy-ethanone Openeye Name: 1-[7-(3-chlorophenyl)-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxy-ethanone CAS Name: 1-[7-(3-chlorophenyl)-9-(2-oxanylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxyethanone IUPAC Name: 1-[7-(3-chlorophenyl)-9-(oxan-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxyethanone Traditional Name: 1-[7-(3-chlorophenyl)-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-methoxy-ethanone Formula: C24H28ClNO5 MolecularWeight: 445.93582

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCOC2=C(C1)C=C(C=C2OCC3CCCCO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COCC(=O)N1CCOC2=C(C1)C=C(C=C2OCC3CCCCO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H28ClNO5/c1-28-16-23(27)26-8-10-30-24-19(14-26)11-18(17-5-4-6-20(25)12-17)13-22(24)31-15-21-7-2-3-9-29-21/h4-6,11-13,21H,2-3,7-10,14-16H2,1H3