2-[3-[(1-ethynylcyclohexyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 2-[3-[(1-ethynylcyclohexyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-[3-[(1-ethynylcyclohexyl)amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-[3-[(1-ethynylcyclohexyl)amino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 2-[3-[(1-ethynylcyclohexyl)amino]-2-hydroxypropoxy]benzonitrile Traditional Name: 2-[3-[(1-ethynylcyclohexyl)amino]-2-hydroxy-propoxy]benzonitrile Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)NCC(COC2=CC=CC=C2C#N)O

Isomeric SMILES

C#CC1(CCCCC1)NCC(COC2=CC=CC=C2C#N)O

InChI

InChI=1S/C18H22N2O2/c1-2-18(10-6-3-7-11-18)20-13-16(21)14-22-17-9-5-4-8-15(17)12-19/h1,4-5,8-9,16,20-21H,3,6-7,10-11,13-14H2