3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzenecarbonitrile

Systemtic Name: 3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzenecarbonitrile Openeye Name: 3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzonitrile CAS Name: 3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzonitrile IUPAC Name: 3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzonitrile Traditional Name: 3-[2-[5-[(E)-but-1-enyl]-1,3-dioxan-2-yl]ethyl]-2-(1,3-dioxan-2-yl)benzonitrile Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1COC(OC1)CCC2=CC=CC(=C2C3OCCCO3)C#N

Isomeric SMILES

CC/C=C/C1COC(OC1)CCC2=CC=CC(=C2C3OCCCO3)C#N

InChI

InChI=1S/C21H27NO4/c1-2-3-6-16-14-25-19(26-15-16)10-9-17-7-4-8-18(13-22)20(17)21-23-11-5-12-24-21/h3-4,6-8,16,19,21H,2,5,9-12,14-15H2,1H3/b6-3+