2-[3-[[1,3-benzoxazol-2-yl(naphthalen-1-ylmethyl)amino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[1,3-benzoxazol-2-yl(naphthalen-1-ylmethyl)amino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[1,3-benzoxazol-2-yl(1-naphthylmethyl)amino]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[1,3-benzoxazol-2-yl(1-naphthalenylmethyl)amino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[1,3-benzoxazol-2-yl(naphthalen-1-ylmethyl)amino]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[[1,3-benzoxazol-2-yl(1-naphthylmethyl)amino]methyl]phenoxy]acetic acid Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN(CC3=CC(=CC=C3)OCC(=O)O)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN(CC3=CC(=CC=C3)OCC(=O)O)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H22N2O4/c30-26(31)18-32-22-11-5-7-19(15-22)16-29(27-28-24-13-3-4-14-25(24)33-27)17-21-10-6-9-20-8-1-2-12-23(20)21/h1-15H,16-18H2,(H,30,31)