phenyl (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)prop-2-eneperoxoate

Systemtic Name: phenyl (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)prop-2-eneperoxoate Openeye Name: phenyl (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyloxazol-2-yl)prop-2-eneperoxoate CAS Name: (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyl-2-oxazolyl)-2-propeneperoxoic acid phenyl ester IUPAC Name: phenyl (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)prop-2-eneperoxoate Traditional Name: (E)-2-(cyclohexylmethyl)-3-(4,5-diphenyloxazol-2-yl)peroxyacrylic acid phenyl ester Formula: C31H29NO4 MolecularWeight: 479.56626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=CC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OOC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C/C(=C\C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)OOC5=CC=CC=C5

InChI

InChI=1S/C31H29NO4/c33-31(36-35-27-19-11-4-12-20-27)26(21-23-13-5-1-6-14-23)22-28-32-29(24-15-7-2-8-16-24)30(34-28)25-17-9-3-10-18-25/h2-4,7-12,15-20,22-23H,1,5-6,13-14,21H2/b26-22+