(3S)-3-methyl-8-(4-phenylmethoxyphenyl)octan-4-one

Systemtic Name: (3S)-3-methyl-8-(4-phenylmethoxyphenyl)octan-4-one Openeye Name: (3S)-8-(4-benzyloxyphenyl)-3-methyl-octan-4-one CAS Name: (3S)-3-methyl-8-(4-phenylmethoxyphenyl)-4-octanone IUPAC Name: (3S)-3-methyl-8-(4-phenylmethoxyphenyl)octan-4-one Traditional Name: (3S)-8-(4-benzoxyphenyl)-3-methyl-octan-4-one Formula: C22H28O2 MolecularWeight: 324.45652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)CCCCC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)C(=O)CCCCC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28O2/c1-3-18(2)22(23)12-8-7-9-19-13-15-21(16-14-19)24-17-20-10-5-4-6-11-20/h4-6,10-11,13-16,18H,3,7-9,12,17H2,1-2H3/t18-/m0/s1