2-(1,3-dioxan-2-yl)-3-[2-(5-pentyl-1,3-dioxan-2-yl)ethyl]benzenecarbonitrile

Systemtic Name: 2-(1,3-dioxan-2-yl)-3-[2-(5-pentyl-1,3-dioxan-2-yl)ethyl]benzenecarbonitrile Openeye Name: 2-(1,3-dioxan-2-yl)-3-[2-(5-pentyl-1,3-dioxan-2-yl)ethyl]benzonitrile CAS Name: 2-(1,3-dioxan-2-yl)-3-[2-(5-pentyl-1,3-dioxan-2-yl)ethyl]benzonitrile IUPAC Name: 2-(1,3-dioxan-2-yl)-3-[2-(5-pentyl-1,3-dioxan-2-yl)ethyl]benzonitrile Traditional Name: 3-[2-(5-amyl-1,3-dioxan-2-yl)ethyl]-2-(1,3-dioxan-2-yl)benzonitrile Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)CCC2=CC=CC(=C2C3OCCCO3)C#N

Isomeric SMILES

CCCCCC1COC(OC1)CCC2=CC=CC(=C2C3OCCCO3)C#N

InChI

InChI=1S/C22H31NO4/c1-2-3-4-7-17-15-26-20(27-16-17)11-10-18-8-5-9-19(14-23)21(18)22-24-12-6-13-25-22/h5,8-9,17,20,22H,2-4,6-7,10-13,15-16H2,1H3