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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCC2=CC=CC=C2.Cl

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCC2=CC=CC=C2.Cl

InChI

InChI=1S/C21H27BrN2O2.ClH/c1-21(2,3)24-20(25)15-26-19-10-9-18(22)13-17(19)14-23-12-11-16-7-5-4-6-8-16;/h4-10,13,23H,11-12,14-15H2,1-3H3,(H,24,25);1H