2-chloranyl-3-[3-methoxy-4-(2-phenylmethoxyethoxy)phenyl]-1H-isoquinoline

Systemtic Name: 2-chloranyl-3-[3-methoxy-4-(2-phenylmethoxyethoxy)phenyl]-1H-isoquinoline Openeye Name: 3-[4-(2-benzyloxyethoxy)-3-methoxy-phenyl]-2-chloro-1H-isoquinoline CAS Name: 2-chloro-3-[3-methoxy-4-(2-phenylmethoxyethoxy)phenyl]-1H-isoquinoline IUPAC Name: 2-chloro-3-[3-methoxy-4-(2-phenylmethoxyethoxy)phenyl]-1H-isoquinoline Traditional Name: 3-[4-(2-benzoxyethoxy)-3-methoxy-phenyl]-2-chloro-1H-isoquinoline Formula: C25H24ClNO3 MolecularWeight: 421.91596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC3=CC=CC=C3CN2Cl)OCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC3=CC=CC=C3CN2Cl)OCCOCC4=CC=CC=C4

InChI

InChI=1S/C25H24ClNO3/c1-28-25-16-21(23-15-20-9-5-6-10-22(20)17-27(23)26)11-12-24(25)30-14-13-29-18-19-7-3-2-4-8-19/h2-12,15-16H,13-14,17-18H2,1H3