ethyl (E)-3-[5-methyl-2-(3-methylphenyl)-4-(1,3-oxazol-4-yl)phenyl]prop-2-eneperoxoate

Systemtic Name: ethyl (E)-3-[5-methyl-2-(3-methylphenyl)-4-(1,3-oxazol-4-yl)phenyl]prop-2-eneperoxoate Openeye Name: ethyl (E)-3-[5-methyl-2-(m-tolyl)-4-oxazol-4-yl-phenyl]prop-2-eneperoxoate CAS Name: (E)-3-[5-methyl-2-(3-methylphenyl)-4-(4-oxazolyl)phenyl]-2-propeneperoxoic acid ethyl ester IUPAC Name: ethyl (E)-3-[5-methyl-2-(3-methylphenyl)-4-(1,3-oxazol-4-yl)phenyl]prop-2-eneperoxoate Traditional Name: (E)-3-[5-methyl-2-(m-tolyl)-4-oxazol-4-yl-phenyl]peroxyacrylic acid ethyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C=CC1=CC(=C(C=C1C2=CC(=CC=C2)C)C3=COC=N3)C

Isomeric SMILES

CCOOC(=O)/C=C/C1=CC(=C(C=C1C2=CC(=CC=C2)C)C3=COC=N3)C

InChI

InChI=1S/C22H21NO4/c1-4-26-27-22(24)9-8-18-11-16(3)19(21-13-25-14-23-21)12-20(18)17-7-5-6-15(2)10-17/h5-14H,4H2,1-3H3/b9-8+