2-azanyl-5-[2-(2-methylbutan-2-ylamino)-1-oxidanyl-ethyl]benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-5-[2-(2-methylbutan-2-ylamino)-1-oxidanyl-ethyl]benzene-1,3-dicarbonitrile Openeye Name: 2-amino-5-[2-(1,1-dimethylpropylamino)-1-hydroxy-ethyl]benzene-1,3-dicarbonitrile CAS Name: 2-amino-5-[1-hydroxy-2-(2-methylbutan-2-ylamino)ethyl]benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-5-[1-hydroxy-2-(2-methylbutan-2-ylamino)ethyl]benzene-1,3-dicarbonitrile Traditional Name: 2-amino-5-[2-(tert-amylamino)-1-hydroxy-ethyl]isophthalonitrile Formula: C15H20N4O MolecularWeight: 272.3455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NCC(C1=CC(=C(C(=C1)C#N)N)C#N)O

Isomeric SMILES

CCC(C)(C)NCC(C1=CC(=C(C(=C1)C#N)N)C#N)O

InChI

InChI=1S/C15H20N4O/c1-4-15(2,3)19-9-13(20)10-5-11(7-16)14(18)12(6-10)8-17/h5-6,13,19-20H,4,9,18H2,1-3H3