(2S,3R)-7-chloranyl-1-phenylmethoxy-3-[(E)-3-phenylmethoxyprop-1-enyl]heptan-2-ol

Systemtic Name: (2S,3R)-7-chloranyl-1-phenylmethoxy-3-[(E)-3-phenylmethoxyprop-1-enyl]heptan-2-ol Openeye Name: (2S,3R)-1-benzyloxy-3-[(E)-3-benzyloxyprop-1-enyl]-7-chloro-heptan-2-ol CAS Name: (2S,3R)-7-chloro-1-phenylmethoxy-3-[(E)-3-phenylmethoxyprop-1-enyl]-2-heptanol IUPAC Name: (2S,3R)-7-chloro-1-phenylmethoxy-3-[(E)-3-phenylmethoxyprop-1-enyl]heptan-2-ol Traditional Name: (E,2S,3R)-1,6-dibenzoxy-3-(4-chlorobutyl)hex-4-en-2-ol Formula: C24H31ClO3 MolecularWeight: 402.95414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC=CC(CCCCCl)C(COCC2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)COC/C=C/[C@@H](CCCCCl)[C@@H](COCC2=CC=CC=C2)O

InChI

InChI=1S/C24H31ClO3/c25-16-8-7-14-23(15-9-17-27-18-21-10-3-1-4-11-21)24(26)20-28-19-22-12-5-2-6-13-22/h1-6,9-13,15,23-24,26H,7-8,14,16-20H2/b15-9+/t23-,24-/m1/s1