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

Systemtic Name: 2-[3-[2-[[3-(2-cyanophenoxy)-2-oxidanyl-propyl]amino]ethylamino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-[3-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethylamino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-[3-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethylamino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 2-[3-[2-[[3-(2-cyanophenoxy)-2-hydroxypropyl]amino]ethylamino]-2-hydroxypropoxy]benzonitrile Traditional Name: 2-[3-[2-[[3-(2-cyanophenoxy)-2-hydroxy-propyl]amino]ethylamino]-2-hydroxy-propoxy]benzonitrile Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O4/c23-11-17-5-1-3-7-21(17)29-15-19(27)13-25-9-10-26-14-20(28)16-30-22-8-4-2-6-18(22)12-24/h1-8,19-20,25-28H,9-10,13-16H2