2-[(1S,2S)-1-ethyl-2-(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-naphthalen-2-yl)-5-oxidanylidene-cyclopentyl]ethyl-triphenyl-phosphanium bromide

Systemtic Name: 2-[(1S,2S)-1-ethyl-2-(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-naphthalen-2-yl)-5-oxidanylidene-cyclopentyl]ethyl-triphenyl-phosphanium bromide Openeye Name: 2-[(1S,2S)-1-ethyl-2-(6-methoxy-1-oxo-tetralin-2-yl)-5-oxo-cyclopentyl]ethyl-triphenyl-phosphonium bromide CAS Name: 2-[(1S,2S)-1-ethyl-2-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-5-oxocyclopentyl]ethyl-triphenylphosphonium bromide IUPAC Name: 2-[(1S,2S)-1-ethyl-2-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-5-oxocyclopentyl]ethyl-triphenylphosphanium bromide Traditional Name: 2-[(1S,5S)-1-ethyl-2-keto-5-(1-keto-6-methoxy-tetralin-2-yl)cyclopentyl]ethyl-triphenyl-phosphonium bromide Formula: C38H40BrO3P MolecularWeight: 655.600161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCC1=O)C2CCC3=C(C2=O)C=CC(=C3)OC)CC[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

Isomeric SMILES

CC[C@@]1([C@@H](CCC1=O)C2CCC3=C(C2=O)C=CC(=C3)OC)CC[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

InChI

InChI=1S/C38H40O3P.BrH/c1-3-38(35(23-24-36(38)39)34-21-19-28-27-29(41-2)20-22-33(28)37(34)40)25-26-42(30-13-7-4-8-14-30,31-15-9-5-10-16-31)32-17-11-6-12-18-32;/h4-18,20,22,27,34-35H,3,19,21,23-26H2,1-2H3;1H/q+1;/p-1/t34?,35-,38-;/m0./s1