4-[3-(tert-butylamino)-2-oxidanyl-propoxy]benzenecarbonitrile hydrochloride

Systemtic Name: 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]benzenecarbonitrile hydrochloride Openeye Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]benzonitrile hydrochloride CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzonitrile hydrochloride IUPAC Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzonitrile hydrochloride Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]benzonitrile hydrochloride Formula: C14H21ClN2O2 MolecularWeight: 284.78174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)C#N)O.Cl

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)C#N)O.Cl

InChI

InChI=1S/C14H20N2O2.ClH/c1-14(2,3)16-9-12(17)10-18-13-6-4-11(8-15)5-7-13;/h4-7,12,16-17H,9-10H2,1-3H3;1H