ethyl 2-[3,3-bis(chloranyl)-2-oxidanylidene-4,5-dihydro-1-benzazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3,3-bis(chloranyl)-2-oxidanylidene-4,5-dihydro-1-benzazepin-1-yl]ethanoate Openeye Name: ethyl 2-(3,3-dichloro-2-oxo-4,5-dihydro-1-benzazepin-1-yl)acetate CAS Name: 2-(3,3-dichloro-2-oxo-4,5-dihydro-1-benzazepin-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3,3-dichloro-2-oxo-4,5-dihydro-1-benzazepin-1-yl)acetate Traditional Name: 2-(3,3-dichloro-2-keto-4,5-dihydro-1-benzazepin-1-yl)acetic acid ethyl ester Formula: C14H15Cl2NO3 MolecularWeight: 316.1798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)(Cl)Cl

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2CCC(C1=O)(Cl)Cl

InChI

InChI=1S/C14H15Cl2NO3/c1-2-20-12(18)9-17-11-6-4-3-5-10(11)7-8-14(15,16)13(17)19/h3-6H,2,7-9H2,1H3