3-[bis(oxidanyl)methyl]-5-(methylamino)benzoic acid

Systemtic Name: 3-[bis(oxidanyl)methyl]-5-(methylamino)benzoic acid Openeye Name: 3-(dihydroxymethyl)-5-(methylamino)benzoic acid CAS Name: 3-(dihydroxymethyl)-5-(methylamino)benzoic acid IUPAC Name: 3-(dihydroxymethyl)-5-(methylamino)benzoic acid Traditional Name: 3-(dihydroxymethyl)-5-(methylamino)benzoic acid Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=CC(=C1)C(O)O)C(=O)O

Isomeric SMILES

CNC1=CC(=CC(=C1)C(O)O)C(=O)O

InChI

InChI=1S/C9H11NO4/c1-10-7-3-5(8(11)12)2-6(4-7)9(13)14/h2-4,8,10-12H,1H3,(H,13,14)