2-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride

Systemtic Name: 2-[3-(2-bromanyl-4-chloranyl-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride Openeye Name: 2-[3-(2-bromo-4-chloro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride CAS Name: 2-[3-(2-bromo-4-chlorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride IUPAC Name: 2-[3-(2-bromo-4-chlorophenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride Traditional Name: 2-[3-(2-bromo-4-chloro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline hydrochloride Formula: C18H20BrCl2NO MolecularWeight: 417.1675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCOC3=C(C=C(C=C3)Cl)Br.Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCOC3=C(C=C(C=C3)Cl)Br.Cl

InChI

InChI=1S/C18H19BrClNO.ClH/c19-17-12-16(20)6-7-18(17)22-11-3-9-21-10-8-14-4-1-2-5-15(14)13-21;/h1-2,4-7,12H,3,8-11,13H2;1H