1-chloranyl-3-(2-phenylmethoxypyridin-4-yl)isoquinoline

Systemtic Name: 1-chloranyl-3-(2-phenylmethoxypyridin-4-yl)isoquinoline Openeye Name: 3-(2-benzyloxy-4-pyridyl)-1-chloro-isoquinoline CAS Name: 1-chloro-3-(2-phenylmethoxy-4-pyridinyl)isoquinoline IUPAC Name: 1-chloro-3-(2-phenylmethoxypyridin-4-yl)isoquinoline Traditional Name: 3-(2-benzoxy-4-pyridyl)-1-chloro-isoquinoline Formula: C21H15ClN2O MolecularWeight: 346.8096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC=CC(=C2)C3=CC4=CC=CC=C4C(=N3)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC=CC(=C2)C3=CC4=CC=CC=C4C(=N3)Cl

InChI

InChI=1S/C21H15ClN2O/c22-21-18-9-5-4-8-16(18)12-19(24-21)17-10-11-23-20(13-17)25-14-15-6-2-1-3-7-15/h1-13H,14H2