N-[5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-3-chloranyl-2-oxidanyl-phenyl]-4-ethoxy-benzamide

Systemtic Name: N-[5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-3-chloranyl-2-oxidanyl-phenyl]-4-ethoxy-benzamide Openeye Name: N-[5-[2-(tert-butylamino)-1-hydroxy-ethyl]-3-chloro-2-hydroxy-phenyl]-4-ethoxy-benzamide CAS Name: N-[5-[2-(tert-butylamino)-1-hydroxyethyl]-3-chloro-2-hydroxyphenyl]-4-ethoxybenzamide IUPAC Name: N-[5-[2-(tert-butylamino)-1-hydroxyethyl]-3-chloro-2-hydroxyphenyl]-4-ethoxybenzamide Traditional Name: N-[5-[2-(tert-butylamino)-1-hydroxy-ethyl]-3-chloro-2-hydroxy-phenyl]-4-ethoxy-benzamide Formula: C21H27ClN2O4 MolecularWeight: 406.90308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=CC(=C2)C(CNC(C)(C)C)O)Cl)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=CC(=C2)C(CNC(C)(C)C)O)Cl)O

InChI

InChI=1S/C21H27ClN2O4/c1-5-28-15-8-6-13(7-9-15)20(27)24-17-11-14(10-16(22)19(17)26)18(25)12-23-21(2,3)4/h6-11,18,23,25-26H,5,12H2,1-4H3,(H,24,27)