1-butyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile

Systemtic Name: 1-butyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Openeye Name: 1-butyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile CAS Name: 1-butyl-4-(5-propyl-1,3-dioxan-2-yl)-1-cyclohexanecarbonitrile IUPAC Name: 1-butyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Traditional Name: 1-butyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile Formula: C18H31NO2 MolecularWeight: 293.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCC(CC1)C2OCC(CO2)CCC)C#N

Isomeric SMILES

CCCCC1(CCC(CC1)C2OCC(CO2)CCC)C#N

InChI

InChI=1S/C18H31NO2/c1-3-5-9-18(14-19)10-7-16(8-11-18)17-20-12-15(6-4-2)13-21-17/h15-17H,3-13H2,1-2H3