2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(2-methylphenyl)ethanoic acid

Systemtic Name: 2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(2-methylphenyl)ethanoic acid Openeye Name: 2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(o-tolyl)acetic acid CAS Name: 2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(2-methylphenyl)acetic acid IUPAC Name: 2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(2-methylphenyl)acetic acid Traditional Name: 2-(1,3-benzoxazol-5-ylmethoxy)-2-(2-cyanophenoxy)-2-(o-tolyl)acetic acid Formula: C24H18N2O5 MolecularWeight: 414.41012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(=O)O)(OCC2=CC3=C(C=C2)OC=N3)OC4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=CC=C1C(C(=O)O)(OCC2=CC3=C(C=C2)OC=N3)OC4=CC=CC=C4C#N

InChI

InChI=1S/C24H18N2O5/c1-16-6-2-4-8-19(16)24(23(27)28,31-21-9-5-3-7-18(21)13-25)30-14-17-10-11-22-20(12-17)26-15-29-22/h2-12,15H,14H2,1H3,(H,27,28)