2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]ethanenitrile

Systemtic Name: 2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]ethanenitrile Openeye Name: 2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]acetonitrile CAS Name: 2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]acetonitrile IUPAC Name: 2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]acetonitrile Traditional Name: 2-[5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrol-3-yl]acetonitrile Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=CC(=CN2)CC#N)C

Isomeric SMILES

CC1(COC(OC1)C2=CC(=CN2)CC#N)C

InChI

InChI=1S/C12H16N2O2/c1-12(2)7-15-11(16-8-12)10-5-9(3-4-13)6-14-10/h5-6,11,14H,3,7-8H2,1-2H3