4-[(5-methyl-2-propan-2-yl-cyclohexyl)oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[(5-methyl-2-propan-2-yl-cyclohexyl)oxymethyl]benzenecarbonitrile Openeye Name: 4-[(2-isopropyl-5-methyl-cyclohexoxy)methyl]benzonitrile CAS Name: 4-[(5-methyl-2-propan-2-ylcyclohexyl)oxymethyl]benzonitrile IUPAC Name: 4-[(5-methyl-2-propan-2-ylcyclohexyl)oxymethyl]benzonitrile Traditional Name: 4-[(2-isopropyl-5-methyl-cyclohexoxy)methyl]benzonitrile Formula: C18H25NO MolecularWeight: 271.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OCC2=CC=C(C=C2)C#N)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OCC2=CC=C(C=C2)C#N)C(C)C

InChI

InChI=1S/C18H25NO/c1-13(2)17-9-4-14(3)10-18(17)20-12-16-7-5-15(11-19)6-8-16/h5-8,13-14,17-18H,4,9-10,12H2,1-3H3