(4S,6S)-6-methyl-4-phenylmethoxy-dodecan-2-one

Systemtic Name: (4S,6S)-6-methyl-4-phenylmethoxy-dodecan-2-one Openeye Name: (4S,6S)-4-benzyloxy-6-methyl-dodecan-2-one CAS Name: (4S,6S)-6-methyl-4-phenylmethoxy-2-dodecanone IUPAC Name: (4S,6S)-6-methyl-4-phenylmethoxydodecan-2-one Traditional Name: (4S,6S)-4-benzoxy-6-methyl-dodecan-2-one Formula: C20H32O2 MolecularWeight: 304.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CC(CC(=O)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCC[C@H](C)C[C@@H](CC(=O)C)OCC1=CC=CC=C1

InChI

InChI=1S/C20H32O2/c1-4-5-6-8-11-17(2)14-20(15-18(3)21)22-16-19-12-9-7-10-13-19/h7,9-10,12-13,17,20H,4-6,8,11,14-16H2,1-3H3/t17-,20-/m0/s1