cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol

Systemtic Name: cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol Openeye Name: cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol CAS Name: cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol IUPAC Name: cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol Traditional Name: cyclohexanecarbonitrile; 2-(methoxymethyl)pentane-1,4-diol Formula: C14H27NO3 MolecularWeight: 257.36908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CO)COC)O.C1CCC(CC1)C#N

Isomeric SMILES

CC(CC(CO)COC)O.C1CCC(CC1)C#N

InChI

InChI=1S/C7H11N.C7H16O3/c8-6-7-4-2-1-3-5-7;1-6(9)3-7(4-8)5-10-2/h7H,1-5H2;6-9H,3-5H2,1-2H3