N-(3-bromanyl-2-oxidanylidene-5,7-diphenyl-azepan-1-yl)-N-tert-butyl-ethanamide

Systemtic Name: N-(3-bromanyl-2-oxidanylidene-5,7-diphenyl-azepan-1-yl)-N-tert-butyl-ethanamide Openeye Name: N-(3-bromo-2-oxo-5,7-diphenyl-azepan-1-yl)-N-tert-butyl-acetamide CAS Name: N-(3-bromo-2-oxo-5,7-diphenyl-1-azepanyl)-N-tert-butylacetamide IUPAC Name: N-(3-bromo-2-oxo-5,7-diphenylazepan-1-yl)-N-tert-butylacetamide Traditional Name: N-(3-bromo-2-keto-5,7-diphenyl-azepan-1-yl)-N-tert-butyl-acetamide Formula: C24H29BrN2O2 MolecularWeight: 457.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)Br)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)Br)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H29BrN2O2/c1-17(28)27(24(2,3)4)26-22(19-13-9-6-10-14-19)16-20(15-21(25)23(26)29)18-11-7-5-8-12-18/h5-14,20-22H,15-16H2,1-4H3