tert-butyl 8-chloranyl-4-oxidanylidene-2,5-dihydro-1H-3-benzazepine-3-carboxylate

Systemtic Name: tert-butyl 8-chloranyl-4-oxidanylidene-2,5-dihydro-1H-3-benzazepine-3-carboxylate Openeye Name: tert-butyl 8-chloro-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylate CAS Name: 8-chloro-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-chloro-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylate Traditional Name: 8-chloro-4-keto-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid tert-butyl ester Formula: C15H18ClNO3 MolecularWeight: 295.76132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(CC1=O)C=CC(=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(CC1=O)C=CC(=C2)Cl

InChI

InChI=1S/C15H18ClNO3/c1-15(2,3)20-14(19)17-7-6-11-8-12(16)5-4-10(11)9-13(17)18/h4-5,8H,6-7,9H2,1-3H3