[4-azanyl-1-ethoxy-1,3-bis(oxidanylidene)pentan-2-yl]-triphenyl-phosphanium bromide hydrobromide

Systemtic Name: [4-azanyl-1-ethoxy-1,3-bis(oxidanylidene)pentan-2-yl]-triphenyl-phosphanium bromide hydrobromide Openeye Name: (3-amino-1-ethoxycarbonyl-2-oxo-butyl)-triphenyl-phosphonium bromide hydrobromide CAS Name: (4-amino-1-ethoxy-1,3-dioxopentan-2-yl)-triphenylphosphonium bromide hydrobromide IUPAC Name: (4-amino-1-ethoxy-1,3-dioxopentan-2-yl)-triphenylphosphanium bromide hydrobromide Traditional Name: (3-amino-1-carbethoxy-2-keto-butyl)-triphenyl-phosphonium bromide hydrobromide Formula: C25H28Br2NO3P MolecularWeight: 581.276481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C(C)N)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.Br.[Br-]

Isomeric SMILES

CCOC(=O)C(C(=O)C(C)N)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.Br.[Br-]

InChI

InChI=1S/C25H27NO3P.2BrH/c1-3-29-25(28)24(23(27)19(2)26)30(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;;/h4-19,24H,3,26H2,1-2H3;2*1H/q+1;;/p-1