2,6-bis(azanyl)-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)hexan-1-one dihydrobromide

Systemtic Name: 2,6-bis(azanyl)-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)hexan-1-one dihydrobromide Openeye Name: 2,6-diamino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)hexan-1-one dihydrobromide CAS Name: 2,6-diamino-1-(2-diphenoxyphosphoryl-1-pyrrolidinyl)-1-hexanone dihydrobromide IUPAC Name: 2,6-diamino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)hexan-1-one dihydrobromide Traditional Name: 2,6-diamino-1-(2-diphenoxyphosphorylpyrrolidino)hexan-1-one dihydrobromide Formula: C22H32Br2N3O4P MolecularWeight: 593.288941

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCN)N)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3.Br.Br

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCCN)N)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3.Br.Br

InChI

InChI=1S/C22H30N3O4P.2BrH/c23-16-8-7-14-20(24)22(26)25-17-9-15-21(25)30(27,28-18-10-3-1-4-11-18)29-19-12-5-2-6-13-19;;/h1-6,10-13,20-21H,7-9,14-17,23-24H2;2*1H