(1R,9aR)-1-(dipentoxyphosphorylsulfanylmethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine

Systemtic Name: (1R,9aR)-1-(dipentoxyphosphorylsulfanylmethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine Openeye Name: (1R,9aR)-1-(dipentoxyphosphorylsulfanylmethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine CAS Name: (1R,9aR)-1-[(dipentoxyphosphorylthio)methyl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine IUPAC Name: (1R,9aR)-1-(dipentoxyphosphorylsulfanylmethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine Traditional Name: (1R,9aR)-1-[(diamoxyphosphorylthio)methyl]quinolizidine Formula: C20H40NO3PS MolecularWeight: 405.575261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOP(=O)(OCCCCC)SCC1CCCN2C1CCCC2

Isomeric SMILES

CCCCCOP(=O)(OCCCCC)SC[C@@H]1CCCN2[C@@H]1CCCC2

InChI

InChI=1S/C20H40NO3PS/c1-3-5-9-16-23-25(22,24-17-10-6-4-2)26-18-19-12-11-15-21-14-8-7-13-20(19)21/h19-20H,3-18H2,1-2H3/t19-,20+/m0/s1