4-(2-fluoranyl-4-methyl-5-phenylmethoxy-phenoxy)-7-(2-methoxyethoxy)quinoline-6-carbonitrile

Systemtic Name: 4-(2-fluoranyl-4-methyl-5-phenylmethoxy-phenoxy)-7-(2-methoxyethoxy)quinoline-6-carbonitrile Openeye Name: 4-(5-benzyloxy-2-fluoro-4-methyl-phenoxy)-7-(2-methoxyethoxy)quinoline-6-carbonitrile CAS Name: 4-(2-fluoro-4-methyl-5-phenylmethoxyphenoxy)-7-(2-methoxyethoxy)-6-quinolinecarbonitrile IUPAC Name: 4-(2-fluoro-4-methyl-5-phenylmethoxyphenoxy)-7-(2-methoxyethoxy)quinoline-6-carbonitrile Traditional Name: 4-(5-benzoxy-2-fluoro-4-methyl-phenoxy)-7-(2-methoxyethoxy)quinoline-6-carbonitrile Formula: C27H23FN2O4 MolecularWeight: 458.480923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC2=CC=CC=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCOC)C#N)F

Isomeric SMILES

CC1=CC(=C(C=C1OCC2=CC=CC=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCOC)C#N)F

InChI

InChI=1S/C27H23FN2O4/c1-18-12-22(28)27(15-25(18)33-17-19-6-4-3-5-7-19)34-24-8-9-30-23-14-26(32-11-10-31-2)20(16-29)13-21(23)24/h3-9,12-15H,10-11,17H2,1-2H3