[1-[1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]-2-oxidanylidene-pyrrolidin-3-yl]-triphenyl-phosphanium bromide

Systemtic Name: [1-[1-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]-2-oxidanylidene-pyrrolidin-3-yl]-triphenyl-phosphanium bromide Openeye Name: [1-[1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]-2-oxo-pyrrolidin-3-yl]-triphenyl-phosphonium bromide CAS Name: [1-[1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxy-oxomethyl]-3-pyrrolidinyl]-2-oxo-3-pyrrolidinyl]-triphenylphosphonium bromide IUPAC Name: [1-[1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]-2-oxopyrrolidin-3-yl]-triphenylphosphanium bromide Traditional Name: [2-keto-1-[1-[(2-keto-5-methyl-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]pyrrolidin-3-yl]-triphenyl-phosphonium bromide Formula: C32H32BrN2O6P MolecularWeight: 651.484041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)O1)COC(=O)N2CCC(C2)N3CCC(C3=O)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

Isomeric SMILES

CC1=C(OC(=O)O1)COC(=O)N2CCC(C2)N3CCC(C3=O)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

InChI

InChI=1S/C32H32N2O6P.BrH/c1-23-28(40-32(37)39-23)22-38-31(36)33-19-17-24(21-33)34-20-18-29(30(34)35)41(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27;/h2-16,24,29H,17-22H2,1H3;1H/q+1;/p-1