3-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-1-methyl-1-oxidanyl-urea

Systemtic Name: 3-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-1-methyl-1-oxidanyl-urea Openeye Name: 1-hydroxy-3-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]-1-methyl-urea CAS Name: 1-hydroxy-3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-1-methylurea IUPAC Name: 1-hydroxy-3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-1-methylurea Traditional Name: 3-homovanillyl-1-hydroxy-1-methyl-urea Formula: C11H16N2O4 MolecularWeight: 240.25574

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NCCC1=CC(=C(C=C1)O)OC)O

Isomeric SMILES

CN(C(=O)NCCC1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C11H16N2O4/c1-13(16)11(15)12-6-5-8-3-4-9(14)10(7-8)17-2/h3-4,7,14,16H,5-6H2,1-2H3,(H,12,15)