4,4-bis(diethoxyphosphoryl)-2-naphthalen-1-yl-butanenitrile

Systemtic Name: 4,4-bis(diethoxyphosphoryl)-2-naphthalen-1-yl-butanenitrile Openeye Name: 4,4-bis(diethoxyphosphoryl)-2-(1-naphthyl)butanenitrile CAS Name: 4,4-bis(diethoxyphosphoryl)-2-(1-naphthalenyl)butanenitrile IUPAC Name: 4,4-bis(diethoxyphosphoryl)-2-naphthalen-1-ylbutanenitrile Traditional Name: 4,4-bis(diethoxyphosphoryl)-2-(1-naphthyl)butyronitrile Formula: C22H31NO6P2 MolecularWeight: 467.432162

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC(C#N)C1=CC=CC2=CC=CC=C21)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(CC(C#N)C1=CC=CC2=CC=CC=C21)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C22H31NO6P2/c1-5-26-30(24,27-6-2)22(31(25,28-7-3)29-8-4)16-19(17-23)21-15-11-13-18-12-9-10-14-20(18)21/h9-15,19,22H,5-8,16H2,1-4H3