methyl 3-[[3,4-bis(oxidanyl)phenyl]methylamino]benzoate

Systemtic Name: methyl 3-[[3,4-bis(oxidanyl)phenyl]methylamino]benzoate Openeye Name: methyl 3-[(3,4-dihydroxyphenyl)methylamino]benzoate CAS Name: 3-[(3,4-dihydroxyphenyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3,4-dihydroxyphenyl)methylamino]benzoate Traditional Name: 3-(protocatechuylamino)benzoic acid methyl ester Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NCC2=CC(=C(C=C2)O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NCC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C15H15NO4/c1-20-15(19)11-3-2-4-12(8-11)16-9-10-5-6-13(17)14(18)7-10/h2-8,16-18H,9H2,1H3