tert-butyl 2-(7-chloranyl-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-5-yl)ethanoate

Systemtic Name: tert-butyl 2-(7-chloranyl-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-5-yl)ethanoate Openeye Name: tert-butyl 2-(7-chloro-2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl)acetate CAS Name: 2-(7-chloro-2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(7-chloro-2-oxo-1,3,4,5-tetrahydro-1-benzazepin-5-yl)acetate Traditional Name: 2-(7-chloro-2-keto-1,3,4,5-tetrahydro-1-benzazepin-5-yl)acetic acid tert-butyl ester Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CCC(=O)NC2=C1C=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CC1CCC(=O)NC2=C1C=C(C=C2)Cl

InChI

InChI=1S/C16H20ClNO3/c1-16(2,3)21-15(20)8-10-4-7-14(19)18-13-6-5-11(17)9-12(10)13/h5-6,9-10H,4,7-8H2,1-3H3,(H,18,19)