methyl 2-[(S)-3-(4-fluorophenyl)pentan-3-ylperoxy-phenyl-methyl]prop-2-enoate

Systemtic Name: methyl 2-[(S)-3-(4-fluorophenyl)pentan-3-ylperoxy-phenyl-methyl]prop-2-enoate Openeye Name: methyl 2-[(S)-[1-ethyl-1-(4-fluorophenyl)propyl]peroxy-phenyl-methyl]prop-2-enoate CAS Name: 2-[(S)-3-(4-fluorophenyl)pentan-3-yldioxy-phenylmethyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[(S)-3-(4-fluorophenyl)pentan-3-ylperoxy-phenylmethyl]prop-2-enoate Traditional Name: 2-[(S)-[1-ethyl-1-(4-fluorophenyl)propyl]peroxy-phenyl-methyl]acrylic acid methyl ester Formula: C22H25FO4 MolecularWeight: 372.429903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC=C(C=C1)F)OOC(C2=CC=CC=C2)C(=C)C(=O)OC

Isomeric SMILES

CCC(CC)(C1=CC=C(C=C1)F)OO[C@@H](C2=CC=CC=C2)C(=C)C(=O)OC

InChI

InChI=1S/C22H25FO4/c1-5-22(6-2,18-12-14-19(23)15-13-18)27-26-20(16(3)21(24)25-4)17-10-8-7-9-11-17/h7-15,20H,3,5-6H2,1-2,4H3/t20-/m1/s1