methyl 3,3-bis(chloranyl)-2-oxidanylidene-4,5-dihydro-1H-1-benzazepine-7-carboxylate

Systemtic Name: methyl 3,3-bis(chloranyl)-2-oxidanylidene-4,5-dihydro-1H-1-benzazepine-7-carboxylate Openeye Name: methyl 3,3-dichloro-2-oxo-4,5-dihydro-1H-1-benzazepine-7-carboxylate CAS Name: 3,3-dichloro-2-oxo-4,5-dihydro-1H-1-benzazepine-7-carboxylic acid methyl ester IUPAC Name: methyl 3,3-dichloro-2-oxo-4,5-dihydro-1H-1-benzazepine-7-carboxylate Traditional Name: 3,3-dichloro-2-keto-4,5-dihydro-1H-1-benzazepine-7-carboxylic acid methyl ester Formula: C12H11Cl2NO3 MolecularWeight: 288.12664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC(=O)C(CC2)(Cl)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC(=O)C(CC2)(Cl)Cl

InChI

InChI=1S/C12H11Cl2NO3/c1-18-10(16)8-2-3-9-7(6-8)4-5-12(13,14)11(17)15-9/h2-3,6H,4-5H2,1H3,(H,15,17)