3-[3-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethylamino]phenyl]benzoic acid

Systemtic Name: 3-[3-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethylamino]phenyl]benzoic acid Openeye Name: 3-[3-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethylamino]phenyl]benzoic acid CAS Name: 3-[3-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethylamino]phenyl]benzoic acid IUPAC Name: 3-[3-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethylamino]phenyl]benzoic acid Traditional Name: 3-[3-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethylamino]phenyl]benzoic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CNCCNC2=CC=CC(=C2)C3=CC(=CC=C3)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(CNCCNC2=CC=CC(=C2)C3=CC(=CC=C3)C(=O)O)O

InChI

InChI=1S/C24H26N2O4/c27-22(17-30-23-10-2-1-3-11-23)16-25-12-13-26-21-9-5-7-19(15-21)18-6-4-8-20(14-18)24(28)29/h1-11,14-15,22,25-27H,12-13,16-17H2,(H,28,29)