(3S,6aR,10aR)-3-(iodanylmethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one

Systemtic Name: (3S,6aR,10aR)-3-(iodanylmethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one Openeye Name: (3S,6aR,10aR)-3-(iodomethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one CAS Name: (3S,6aR,10aR)-3-(iodomethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one IUPAC Name: (3S,6aR,10aR)-3-(iodomethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one Traditional Name: (3S,6aR,10aR)-3-(iodomethyl)-3,4,5,6,6a,7,8,9,10,10a-decahydrobenzo[c]oxocin-1-one Formula: C12H19IO2 MolecularWeight: 322.18253

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CCCC(OC2=O)CI

Isomeric SMILES

C1CC[C@@H]2[C@H](C1)CCC[C@H](OC2=O)CI

InChI

InChI=1S/C12H19IO2/c13-8-10-6-3-5-9-4-1-2-7-11(9)12(14)15-10/h9-11H,1-8H2/t9-,10+,11-/m1/s1