N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-cyano-phenyl]-3,3-dimethyl-butanamide hydrochloride

Systemtic Name: N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-cyano-phenyl]-3,3-dimethyl-butanamide hydrochloride Openeye Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-cyano-phenyl]-3,3-dimethyl-butanamide hydrochloride CAS Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-cyanophenyl]-3,3-dimethylbutanamide hydrochloride IUPAC Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-cyanophenyl]-3,3-dimethylbutanamide hydrochloride Traditional Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-cyano-phenyl]-3,3-dimethyl-butyramide hydrochloride Formula: C20H32ClN3O3 MolecularWeight: 397.93938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C#N.Cl

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C#N.Cl

InChI

InChI=1S/C20H31N3O3.ClH/c1-19(2,3)10-18(25)23-15-7-8-17(14(9-15)11-21)26-13-16(24)12-22-20(4,5)6;/h7-9,16,22,24H,10,12-13H2,1-6H3,(H,23,25);1H