tert-butyl 7-(trifluoromethyloxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate

Systemtic Name: tert-butyl 7-(trifluoromethyloxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate Openeye Name: tert-butyl 7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate CAS Name: 7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate Traditional Name: 7-(trifluoromethoxy)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylic acid tert-butyl ester Formula: C16H20F3NO3 MolecularWeight: 331.33011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC2=C1C=CC(=C2)OC(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC2=C1C=CC(=C2)OC(F)(F)F

InChI

InChI=1S/C16H20F3NO3/c1-15(2,3)23-14(21)20-9-5-4-6-11-10-12(7-8-13(11)20)22-16(17,18)19/h7-8,10H,4-6,9H2,1-3H3