2-azanyl-5-[2-(2-methylbutan-2-ylamino)-1-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 2-azanyl-5-[2-(2-methylbutan-2-ylamino)-1-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 2-amino-5-[2-(1,1-dimethylpropylamino)-1-hydroxy-ethyl]benzonitrile CAS Name: 2-amino-5-[1-hydroxy-2-(2-methylbutan-2-ylamino)ethyl]benzonitrile IUPAC Name: 2-amino-5-[1-hydroxy-2-(2-methylbutan-2-ylamino)ethyl]benzonitrile Traditional Name: 2-amino-5-[2-(tert-amylamino)-1-hydroxy-ethyl]benzonitrile Formula: C14H21N3O MolecularWeight: 247.33604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-4-14(2,3)17-9-13(18)10-5-6-12(16)11(7-10)8-15/h5-7,13,17-18H,4,9,16H2,1-3H3