3-[(2-oxidanyl-3-prop-2-enoxy-propyl)amino]benzoic acid

Systemtic Name: 3-[(2-oxidanyl-3-prop-2-enoxy-propyl)amino]benzoic acid Openeye Name: 3-[(3-allyloxy-2-hydroxy-propyl)amino]benzoic acid CAS Name: 3-[(2-hydroxy-3-prop-2-enoxypropyl)amino]benzoic acid IUPAC Name: 3-[(2-hydroxy-3-prop-2-enoxypropyl)amino]benzoic acid Traditional Name: 3-[(3-allyloxy-2-hydroxy-propyl)amino]benzoic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-2-6-18-9-12(15)8-14-11-5-3-4-10(7-11)13(16)17/h2-5,7,12,14-15H,1,6,8-9H2,(H,16,17)