2-[2-[[3-[(6-methoxyquinolin-2-yl)methoxymethyl]phenoxy]methyl]-6-methyl-phenoxy]ethanenitrile

Systemtic Name: 2-[2-[[3-[(6-methoxyquinolin-2-yl)methoxymethyl]phenoxy]methyl]-6-methyl-phenoxy]ethanenitrile Openeye Name: 2-[2-[[3-[(6-methoxy-2-quinolyl)methoxymethyl]phenoxy]methyl]-6-methyl-phenoxy]acetonitrile CAS Name: 2-[2-[[3-[(6-methoxy-2-quinolinyl)methoxymethyl]phenoxy]methyl]-6-methylphenoxy]acetonitrile IUPAC Name: 2-[2-[[3-[(6-methoxyquinolin-2-yl)methoxymethyl]phenoxy]methyl]-6-methylphenoxy]acetonitrile Traditional Name: 2-[2-[[3-[(6-methoxy-2-quinolyl)methoxymethyl]phenoxy]methyl]-6-methyl-phenoxy]acetonitrile Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=NC4=C(C=C3)C=C(C=C4)OC)OCC#N

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC=CC(=C2)COCC3=NC4=C(C=C3)C=C(C=C4)OC)OCC#N

InChI

InChI=1S/C28H26N2O4/c1-20-5-3-7-23(28(20)33-14-13-29)18-34-26-8-4-6-21(15-26)17-32-19-24-10-9-22-16-25(31-2)11-12-27(22)30-24/h3-12,15-16H,14,17-19H2,1-2H3