tetraethyl (2S,5S)-1-methyl-2,5-bis(phenylcarbonyl)pyrrolidin-1-ium-3,3,4,4-tetracarboxylate

Systemtic Name: tetraethyl (2S,5S)-1-methyl-2,5-bis(phenylcarbonyl)pyrrolidin-1-ium-3,3,4,4-tetracarboxylate Openeye Name: tetraethyl (2S,5S)-2,5-dibenzoyl-1-methyl-pyrrolidin-1-ium-3,3,4,4-tetracarboxylate CAS Name: (2S,5S)-2,5-dibenzoyl-1-methylpyrrolidin-1-ium-3,3,4,4-tetracarboxylic acid tetraethyl ester IUPAC Name: tetraethyl (2S,5S)-2,5-dibenzoyl-1-methylpyrrolidin-1-ium-3,3,4,4-tetracarboxylate Traditional Name: (2S,5S)-2,5-dibenzoyl-1-methyl-pyrrolidin-1-ium-3,3,4,4-tetracarboxylic acid tetraethyl ester Formula: C31H36NO10+ MolecularWeight: 582.61824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C([NH+](C(C1(C(=O)OCC)C(=O)OCC)C(=O)C2=CC=CC=C2)C)C(=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1([C@H]([NH+]([C@@H](C1(C(=O)OCC)C(=O)OCC)C(=O)C2=CC=CC=C2)C)C(=O)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C31H35NO10/c1-6-39-26(35)30(27(36)40-7-2)24(22(33)20-16-12-10-13-17-20)32(5)25(23(34)21-18-14-11-15-19-21)31(30,28(37)41-8-3)29(38)42-9-4/h10-19,24-25H,6-9H2,1-5H3/p+1/t24-,25-/m1/s1