methyl 2-[[3,4-bis(oxidanyl)phenyl]-methyl-amino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[[3,4-bis(oxidanyl)phenyl]-methyl-amino]-3-oxidanyl-propanoate Openeye Name: methyl 2-(3,4-dihydroxy-N-methyl-anilino)-3-hydroxy-propanoate CAS Name: 2-(3,4-dihydroxy-N-methylanilino)-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydroxy-N-methylanilino)-3-hydroxypropanoate Traditional Name: 2-(3,4-dihydroxy-N-methyl-anilino)-3-hydroxy-propionic acid methyl ester Formula: C11H15NO5 MolecularWeight: 241.2405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO5/c1-12(8(6-13)11(16)17-2)7-3-4-9(14)10(15)5-7/h3-5,8,13-15H,6H2,1-2H3