2-[4-bromanyl-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butyl-ethanamide hydrochloride

Systemtic Name: 2-[4-bromanyl-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butyl-ethanamide hydrochloride Openeye Name: 2-[4-bromo-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butyl-acetamide hydrochloride CAS Name: 2-[4-bromo-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butylacetamide hydrochloride IUPAC Name: 2-[4-bromo-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butylacetamide hydrochloride Traditional Name: 2-[4-bromo-2-[(1-phenylethylamino)methyl]phenoxy]-N-tert-butyl-acetamide hydrochloride Formula: C21H28BrClN2O2 MolecularWeight: 455.81622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2=C(C=CC(=C2)Br)OCC(=O)NC(C)(C)C.Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2=C(C=CC(=C2)Br)OCC(=O)NC(C)(C)C.Cl

InChI

InChI=1S/C21H27BrN2O2.ClH/c1-15(16-8-6-5-7-9-16)23-13-17-12-18(22)10-11-19(17)26-14-20(25)24-21(2,3)4;/h5-12,15,23H,13-14H2,1-4H3,(H,24,25);1H