2-[[bis(2-methylpropyl)amino]methyl]-4-phenyl-1,4-oxazepane-5,7-dione hydrobromide

Systemtic Name: 2-[[bis(2-methylpropyl)amino]methyl]-4-phenyl-1,4-oxazepane-5,7-dione hydrobromide Openeye Name: 2-[(diisobutylamino)methyl]-4-phenyl-1,4-oxazepane-5,7-dione hydrobromide CAS Name: 2-[[bis(2-methylpropyl)amino]methyl]-4-phenyl-1,4-oxazepane-5,7-dione hydrobromide IUPAC Name: 2-[[bis(2-methylpropyl)amino]methyl]-4-phenyl-1,4-oxazepane-5,7-dione hydrobromide Traditional Name: 2-[(diisobutylamino)methyl]-4-phenyl-1,4-oxazepane-5,7-quinone hydrobromide Formula: C20H31BrN2O3 MolecularWeight: 427.37574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CN(C(=O)CC(=O)O1)C2=CC=CC=C2)CC(C)C.Br

Isomeric SMILES

CC(C)CN(CC1CN(C(=O)CC(=O)O1)C2=CC=CC=C2)CC(C)C.Br

InChI

InChI=1S/C20H30N2O3.BrH/c1-15(2)11-21(12-16(3)4)13-18-14-22(17-8-6-5-7-9-17)19(23)10-20(24)25-18;/h5-9,15-16,18H,10-14H2,1-4H3;1H