2-[2-(1,3-benzoxazol-2-yl)-4-chloranyl-phenoxy]-2-(4-methoxyphenyl)ethanoic acid

Systemtic Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chloranyl-phenoxy]-2-(4-methoxyphenyl)ethanoic acid Openeye Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chloro-phenoxy]-2-(4-methoxyphenyl)acetic acid CAS Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chlorophenoxy]-2-(4-methoxyphenyl)acetic acid IUPAC Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chlorophenoxy]-2-(4-methoxyphenyl)acetic acid Traditional Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chloro-phenoxy]-2-(4-methoxyphenyl)acetic acid Formula: C22H16ClNO5 MolecularWeight: 409.81914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)C(C(=O)O)OC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H16ClNO5/c1-27-15-9-6-13(7-10-15)20(22(25)26)28-18-11-8-14(23)12-16(18)21-24-17-4-2-3-5-19(17)29-21/h2-12,20H,1H3,(H,25,26)