2-[[3-[(2-carboxy-4-oxidanyl-phenyl)carbonylamino]propylamino]oxymethyl]-5-oxidanyl-benzoic acid

Systemtic Name: 2-[[3-[(2-carboxy-4-oxidanyl-phenyl)carbonylamino]propylamino]oxymethyl]-5-oxidanyl-benzoic acid Openeye Name: 2-[[3-[(2-carboxy-4-hydroxy-benzoyl)amino]propylamino]oxymethyl]-5-hydroxy-benzoic acid CAS Name: 2-[[3-[[(2-carboxy-4-hydroxyphenyl)-oxomethyl]amino]propylamino]oxymethyl]-5-hydroxybenzoic acid IUPAC Name: 2-[[3-[(2-carboxy-4-hydroxybenzoyl)amino]propylamino]oxymethyl]-5-hydroxybenzoic acid Traditional Name: 2-[[3-[(2-carboxy-4-hydroxy-benzoyl)amino]propylamino]oxymethyl]-5-hydroxy-benzoic acid Formula: C19H20N2O8 MolecularWeight: 404.3707

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C(=O)O)CONCCCNC(=O)C2=C(C=C(C=C2)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1O)C(=O)O)CONCCCNC(=O)C2=C(C=C(C=C2)O)C(=O)O

InChI

InChI=1S/C19H20N2O8/c22-12-3-2-11(15(8-12)18(25)26)10-29-21-7-1-6-20-17(24)14-5-4-13(23)9-16(14)19(27)28/h2-5,8-9,21-23H,1,6-7,10H2,(H,20,24)(H,25,26)(H,27,28)