2-[2-bromanyl-6-methoxy-4-[[(phenylmethyl)amino]methyl]phenoxy]-N-tert-butyl-ethanamide hydrochloride

Systemtic Name: 2-[2-bromanyl-6-methoxy-4-[[(phenylmethyl)amino]methyl]phenoxy]-N-tert-butyl-ethanamide hydrochloride Openeye Name: 2-[4-[(benzylamino)methyl]-2-bromo-6-methoxy-phenoxy]-N-tert-butyl-acetamide hydrochloride CAS Name: 2-[2-bromo-6-methoxy-4-[[(phenylmethyl)amino]methyl]phenoxy]-N-tert-butylacetamide hydrochloride IUPAC Name: 2-[4-[(benzylamino)methyl]-2-bromo-6-methoxyphenoxy]-N-tert-butylacetamide hydrochloride Traditional Name: 2-[4-[(benzylamino)methyl]-2-bromo-6-methoxy-phenoxy]-N-tert-butyl-acetamide hydrochloride Formula: C21H28BrClN2O3 MolecularWeight: 471.81562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1Br)CNCC2=CC=CC=C2)OC.Cl

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1Br)CNCC2=CC=CC=C2)OC.Cl

InChI

InChI=1S/C21H27BrN2O3.ClH/c1-21(2,3)24-19(25)14-27-20-17(22)10-16(11-18(20)26-4)13-23-12-15-8-6-5-7-9-15;/h5-11,23H,12-14H2,1-4H3,(H,24,25);1H