(5-ethanoyl-2-ethoxy-phenyl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN2C(=O)CCOC3=CC=CC=C32

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CN2C(=O)CCOC3=CC=CC=C32

InChI

InChI=1S/C22H23NO6/c1-3-27-19-9-8-16(15(2)24)12-17(19)14-29-22(26)13-23-18-6-4-5-7-20(18)28-11-10-21(23)25/h4-9,12H,3,10-11,13-14H2,1-2H3