(1S,3S)-1-phenylheptane-1,3-diol

Systemtic Name: (1S,3S)-1-phenylheptane-1,3-diol Openeye Name: (1S,3S)-1-phenylheptane-1,3-diol CAS Name: (1S,3S)-1-phenylheptane-1,3-diol IUPAC Name: (1S,3S)-1-phenylheptane-1,3-diol Traditional Name: (1S,3S)-1-phenylheptane-1,3-diol Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C1=CC=CC=C1)O)O

Isomeric SMILES

CCCC[C@@H](C[C@@H](C1=CC=CC=C1)O)O

InChI

InChI=1S/C13H20O2/c1-2-3-9-12(14)10-13(15)11-7-5-4-6-8-11/h4-8,12-15H,2-3,9-10H2,1H3/t12-,13-/m0/s1