N-[3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-5-phenylmethoxy-phenyl]ethanamide hydrochloride

Systemtic Name: N-[3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-5-phenylmethoxy-phenyl]ethanamide hydrochloride Openeye Name: N-[3-benzyloxy-5-[2-(tert-butylamino)-1-hydroxy-ethyl]phenyl]acetamide hydrochloride CAS Name: N-[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-phenylmethoxyphenyl]acetamide hydrochloride IUPAC Name: N-[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-phenylmethoxyphenyl]acetamide hydrochloride Traditional Name: N-[3-benzoxy-5-[2-(tert-butylamino)-1-hydroxy-ethyl]phenyl]acetamide hydrochloride Formula: C21H29ClN2O3 MolecularWeight: 392.91956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OCC2=CC=CC=C2.Cl

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OCC2=CC=CC=C2.Cl

InChI

InChI=1S/C21H28N2O3.ClH/c1-15(24)23-18-10-17(20(25)13-22-21(2,3)4)11-19(12-18)26-14-16-8-6-5-7-9-16;/h5-12,20,22,25H,13-14H2,1-4H3,(H,23,24);1H