methyl 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-methylphenyl)ethanoate

Systemtic Name: methyl 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-methylphenyl)ethanoate Openeye Name: methyl 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(o-tolyl)acetate CAS Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyanophenoxy]-2-(2-methylphenyl)acetic acid methyl ester IUPAC Name: methyl 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyanophenoxy]-2-(2-methylphenyl)acetate Traditional Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(o-tolyl)acetic acid methyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(=O)OC)OC2=C(C=CC(=C2)OCC3=CC4=C(C=C3)N=CO4)C#N

Isomeric SMILES

CC1=CC=CC=C1C(C(=O)OC)OC2=C(C=CC(=C2)OCC3=CC4=C(C=C3)N=CO4)C#N

InChI

InChI=1S/C25H20N2O5/c1-16-5-3-4-6-20(16)24(25(28)29-2)32-22-12-19(9-8-18(22)13-26)30-14-17-7-10-21-23(11-17)31-15-27-21/h3-12,15,24H,14H2,1-2H3