2-[8-[3-(diethoxyphosphorylmethyl)phenyl]quinolin-6-yl]-2-methyl-propanenitrile

Systemtic Name: 2-[8-[3-(diethoxyphosphorylmethyl)phenyl]quinolin-6-yl]-2-methyl-propanenitrile Openeye Name: 2-[8-[3-(diethoxyphosphorylmethyl)phenyl]-6-quinolyl]-2-methyl-propanenitrile CAS Name: 2-[8-[3-(diethoxyphosphorylmethyl)phenyl]-6-quinolinyl]-2-methylpropanenitrile IUPAC Name: 2-[8-[3-(diethoxyphosphorylmethyl)phenyl]quinolin-6-yl]-2-methylpropanenitrile Traditional Name: 2-[8-[3-(diethoxyphosphorylmethyl)phenyl]-6-quinolyl]-2-methyl-propionitrile Formula: C24H27N2O3P MolecularWeight: 422.456541

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)C#N)C=CC=N3)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)C#N)C=CC=N3)OCC

InChI

InChI=1S/C24H27N2O3P/c1-5-28-30(27,29-6-2)16-18-9-7-10-19(13-18)22-15-21(24(3,4)17-25)14-20-11-8-12-26-23(20)22/h7-15H,5-6,16H2,1-4H3