2-[[(2R)-1-methyl-1-[2-(phenylcarbonyloxy)ethyl]pyrrolidin-1-ium-2-yl]methoxy]-2-oxidanylidene-1,1-diphenyl-ethanolate

Systemtic Name: 2-[[(2R)-1-methyl-1-[2-(phenylcarbonyloxy)ethyl]pyrrolidin-1-ium-2-yl]methoxy]-2-oxidanylidene-1,1-diphenyl-ethanolate Openeye Name: 2-[[(2R)-1-(2-benzoyloxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methoxy]-2-oxo-1,1-diphenyl-ethanolate CAS Name: 2-[[(2R)-1-(2-benzoyloxyethyl)-1-methyl-2-pyrrolidin-1-iumyl]methoxy]-2-oxo-1,1-diphenylethanolate IUPAC Name: 2-[[(2R)-1-(2-benzoyloxyethyl)-1-methylpyrrolidin-1-ium-2-yl]methoxy]-2-oxo-1,1-diphenylethanolate Traditional Name: 2-[[(2R)-1-(2-benzoyloxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methoxy]-2-keto-1,1-diphenyl-ethanolate Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)[O-])CCOC(=O)C4=CC=CC=C4

Isomeric SMILES

C[N+]1(CCC[C@@H]1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)[O-])CCOC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H31NO5/c1-30(20-21-34-27(31)23-12-5-2-6-13-23)19-11-18-26(30)22-35-28(32)29(33,24-14-7-3-8-15-24)25-16-9-4-10-17-25/h2-10,12-17,26H,11,18-22H2,1H3/t26-,30?/m1/s1