(5S,8S)-6-bromanyl-8-heptyl-5-pentyl-5,8-dihydronaphthalene-1,4-dione

Systemtic Name: (5S,8S)-6-bromanyl-8-heptyl-5-pentyl-5,8-dihydronaphthalene-1,4-dione Openeye Name: (5S,8S)-6-bromo-8-heptyl-5-pentyl-5,8-dihydronaphthalene-1,4-dione CAS Name: (5S,8S)-6-bromo-8-heptyl-5-pentyl-5,8-dihydronaphthalene-1,4-dione IUPAC Name: (5S,8S)-6-bromo-8-heptyl-5-pentyl-5,8-dihydronaphthalene-1,4-dione Traditional Name: (5S,8S)-5-amyl-6-bromo-8-heptyl-5,8-dihydronaphthalene-1,4-quinone Formula: C22H31BrO2 MolecularWeight: 407.38434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C=C(C(C2=C1C(=O)C=CC2=O)CCCCC)Br

Isomeric SMILES

CCCCCCC[C@H]1C=C([C@H](C2=C1C(=O)C=CC2=O)CCCCC)Br

InChI

InChI=1S/C22H31BrO2/c1-3-5-7-8-10-11-16-15-18(23)17(12-9-6-4-2)22-20(25)14-13-19(24)21(16)22/h13-17H,3-12H2,1-2H3/t16-,17+/m0/s1