1-[3,4-bis(oxidanyl)phenyl]-2-(2-octoxyethylamino)ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(2-octoxyethylamino)ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(2-octoxyethylamino)ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-(2-octoxyethylamino)ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(2-octoxyethylamino)ethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-(2-octoxyethylamino)ethanone Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCCNCC(=O)C1=CC(=C(C=C1)O)O

Isomeric SMILES

CCCCCCCCOCCNCC(=O)C1=CC(=C(C=C1)O)O

InChI

InChI=1S/C18H29NO4/c1-2-3-4-5-6-7-11-23-12-10-19-14-18(22)15-8-9-16(20)17(21)13-15/h8-9,13,19-21H,2-7,10-12,14H2,1H3