3-[3-[2-(4-aminophenyl)ethylamino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-[2-(4-aminophenyl)ethylamino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 3-[3-[2-(4-aminophenyl)ethylamino]-2-hydroxy-propoxy]benzonitrile CAS Name: 3-[3-[2-(4-aminophenyl)ethylamino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 3-[3-[2-(4-aminophenyl)ethylamino]-2-hydroxypropoxy]benzonitrile Traditional Name: 3-[3-[2-(4-aminophenyl)ethylamino]-2-hydroxy-propoxy]benzonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(CNCCC2=CC=C(C=C2)N)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCC(CNCCC2=CC=C(C=C2)N)O)C#N

InChI

InChI=1S/C18H21N3O2/c19-11-15-2-1-3-18(10-15)23-13-17(22)12-21-9-8-14-4-6-16(20)7-5-14/h1-7,10,17,21-22H,8-9,12-13,20H2