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

Systemtic Name: ethyl 3-[[3,4-bis(oxidanyl)phenyl]methylamino]benzoate Openeye Name: ethyl 3-[(3,4-dihydroxyphenyl)methylamino]benzoate CAS Name: 3-[(3,4-dihydroxyphenyl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dihydroxyphenyl)methylamino]benzoate Traditional Name: 3-(protocatechuylamino)benzoic acid ethyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO4/c1-2-21-16(20)12-4-3-5-13(9-12)17-10-11-6-7-14(18)15(19)8-11/h3-9,17-19H,2,10H2,1H3