2-oxidanyl-4-[[4-(3-oxidanylprop-1-ynyl)phenyl]methylamino]benzoic acid

Systemtic Name: 2-oxidanyl-4-[[4-(3-oxidanylprop-1-ynyl)phenyl]methylamino]benzoic acid Openeye Name: 2-hydroxy-4-[[4-(3-hydroxyprop-1-ynyl)phenyl]methylamino]benzoic acid CAS Name: 2-hydroxy-4-[[4-(3-hydroxyprop-1-ynyl)phenyl]methylamino]benzoic acid IUPAC Name: 2-hydroxy-4-[[4-(3-hydroxyprop-1-ynyl)phenyl]methylamino]benzoic acid Traditional Name: 2-hydroxy-4-[[4-(3-hydroxyprop-1-ynyl)benzyl]amino]benzoic acid Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=CC(=C(C=C2)C(=O)O)O)C#CCO

Isomeric SMILES

C1=CC(=CC=C1CNC2=CC(=C(C=C2)C(=O)O)O)C#CCO

InChI

InChI=1S/C17H15NO4/c19-9-1-2-12-3-5-13(6-4-12)11-18-14-7-8-15(17(21)22)16(20)10-14/h3-8,10,18-20H,9,11H2,(H,21,22)