N-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]-3-bromanyl-N-propan-2-yl-benzamide

Systemtic Name: N-[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]-3-bromanyl-N-propan-2-yl-benzamide Openeye Name: 3-bromo-N-[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]-N-isopropyl-benzamide CAS Name: 3-bromo-N-[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-N-propan-2-ylbenzamide IUPAC Name: 3-bromo-N-[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]-N-propan-2-ylbenzamide Traditional Name: 3-bromo-N-[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]-N-isopropyl-benzamide Formula: C18H20BrNO4 MolecularWeight: 394.2597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(C1=CC(=C(C=C1)O)O)O)C(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)N(CC(C1=CC(=C(C=C1)O)O)O)C(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H20BrNO4/c1-11(2)20(18(24)13-4-3-5-14(19)8-13)10-17(23)12-6-7-15(21)16(22)9-12/h3-9,11,17,21-23H,10H2,1-2H3