[(3R)-2-oxidanylidene-1-[1-(phenylmethyl)pyrrolidin-3-yl]pyrrolidin-3-yl]-triphenyl-phosphanium bromide

Systemtic Name: [(3R)-2-oxidanylidene-1-[1-(phenylmethyl)pyrrolidin-3-yl]pyrrolidin-3-yl]-triphenyl-phosphanium bromide Openeye Name: [(3R)-1-(1-benzylpyrrolidin-3-yl)-2-oxo-pyrrolidin-3-yl]-triphenyl-phosphonium bromide CAS Name: [(3R)-2-oxo-1-[1-(phenylmethyl)-3-pyrrolidinyl]-3-pyrrolidinyl]-triphenylphosphonium bromide IUPAC Name: [(3R)-1-(1-benzylpyrrolidin-3-yl)-2-oxopyrrolidin-3-yl]-triphenylphosphanium bromide Traditional Name: [(3R)-1-(1-benzylpyrrolidin-3-yl)-2-keto-pyrrolidin-3-yl]-triphenyl-phosphonium bromide Formula: C33H34BrN2OP MolecularWeight: 585.513621

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N2CCC(C2=O)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6.[Br-]

Isomeric SMILES

C1CN(C(=O)[C@@H]1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5CCN(C5)CC6=CC=CC=C6.[Br-]

InChI

InChI=1S/C33H34N2OP.BrH/c36-33-32(22-24-35(33)28-21-23-34(26-28)25-27-13-5-1-6-14-27)37(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31;/h1-20,28,32H,21-26H2;1H/q+1;/p-1/t28?,32-;/m1./s1