4-[[[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]amino]methyl]benzene-1,2-diol

Systemtic Name: 4-[[[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]amino]methyl]benzene-1,2-diol Openeye Name: 4-[[[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]amino]methyl]benzene-1,2-diol CAS Name: 4-[[[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]amino]methyl]benzene-1,2-diol IUPAC Name: 4-[[[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]amino]methyl]benzene-1,2-diol Traditional Name: 4-[[[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]amino]methyl]pyrocatechol Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNCC2=CC(=C(C=C2)O)O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNCC2=CC(=C(C=C2)O)O)O)OC

InChI

InChI=1S/C17H21NO5/c1-22-16-6-4-12(8-17(16)23-2)15(21)10-18-9-11-3-5-13(19)14(20)7-11/h3-8,15,18-21H,9-10H2,1-2H3