ethyl 2-(7-oxidanyl-3-oxidanylidene-2-phenethyl-1H-2-benzazepin-4-yl)ethanoate

Systemtic Name: ethyl 2-(7-oxidanyl-3-oxidanylidene-2-phenethyl-1H-2-benzazepin-4-yl)ethanoate Openeye Name: ethyl 2-(7-hydroxy-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl)acetate CAS Name: 2-(7-hydroxy-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(7-hydroxy-3-oxo-2-phenethyl-1H-2-benzazepin-4-yl)acetate Traditional Name: 2-(7-hydroxy-3-keto-2-phenethyl-1H-2-benzazepin-4-yl)acetic acid ethyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC2=C(CN(C1=O)CCC3=CC=CC=C3)C=CC(=C2)O

Isomeric SMILES

CCOC(=O)CC1=CC2=C(CN(C1=O)CCC3=CC=CC=C3)C=CC(=C2)O

InChI

InChI=1S/C22H23NO4/c1-2-27-21(25)14-19-12-18-13-20(24)9-8-17(18)15-23(22(19)26)11-10-16-6-4-3-5-7-16/h3-9,12-13,24H,2,10-11,14-15H2,1H3