4-(4-butyl-1,3-dioxan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(4-butyl-1,3-dioxan-2-yl)benzenecarbonitrile Openeye Name: 4-(4-butyl-1,3-dioxan-2-yl)benzonitrile CAS Name: 4-(4-butyl-1,3-dioxan-2-yl)benzonitrile IUPAC Name: 4-(4-butyl-1,3-dioxan-2-yl)benzonitrile Traditional Name: 4-(4-butyl-1,3-dioxan-2-yl)benzonitrile Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCOC(O1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCC1CCOC(O1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H19NO2/c1-2-3-4-14-9-10-17-15(18-14)13-7-5-12(11-16)6-8-13/h5-8,14-15H,2-4,9-10H2,1H3