2-[3-[3-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]propylamino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 2-[3-[3-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]propylamino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-[3-[3-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]propylamino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-[3-[3-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]propylamino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 2-[3-[3-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]propylamino]-2-hydroxypropoxy]benzonitrile Traditional Name: 2-[3-[3-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]propylamino]-2-hydroxy-propoxy]benzonitrile Formula: C23H28N4O4 MolecularWeight: 424.49282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OCC(CNCCCNCC(COC2=CC=CC=C2C#N)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OCC(CNCCCNCC(COC2=CC=CC=C2C#N)O)O

InChI

InChI=1S/C23H28N4O4/c24-12-18-6-1-3-8-22(18)30-16-20(28)14-26-10-5-11-27-15-21(29)17-31-23-9-4-2-7-19(23)13-25/h1-4,6-9,20-21,26-29H,5,10-11,14-17H2