ethyl 2,5-dicyclohexyl-1,4-bis(4-methylphenyl)-1-oxidanidyl-2,4-bis(oxidanyl)pyrrolidin-1-ium-3-carboxylate

Systemtic Name: ethyl 2,5-dicyclohexyl-1,4-bis(4-methylphenyl)-1-oxidanidyl-2,4-bis(oxidanyl)pyrrolidin-1-ium-3-carboxylate Openeye Name: ethyl 2,5-dicyclohexyl-2,4-dihydroxy-1-oxido-1,4-bis(p-tolyl)pyrrolidin-1-ium-3-carboxylate CAS Name: 2,5-dicyclohexyl-2,4-dihydroxy-1,4-bis(4-methylphenyl)-1-oxido-3-pyrrolidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dicyclohexyl-2,4-dihydroxy-1,4-bis(4-methylphenyl)-1-oxidopyrrolidin-1-ium-3-carboxylate Traditional Name: 2,5-dicyclohexyl-2,4-dihydroxy-1-oxido-1,4-bis(p-tolyl)pyrrolidin-1-ium-3-carboxylic acid ethyl ester Formula: C33H45NO5 MolecularWeight: 535.7141

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C([N+](C(C1(C2=CC=C(C=C2)C)O)C3CCCCC3)(C4=CC=C(C=C4)C)[O-])(C5CCCCC5)O

Isomeric SMILES

CCOC(=O)C1C([N+](C(C1(C2=CC=C(C=C2)C)O)C3CCCCC3)(C4=CC=C(C=C4)C)[O-])(C5CCCCC5)O

InChI

InChI=1S/C33H45NO5/c1-4-39-31(35)29-32(36,26-19-15-23(2)16-20-26)30(25-11-7-5-8-12-25)34(38,28-21-17-24(3)18-22-28)33(29,37)27-13-9-6-10-14-27/h15-22,25,27,29-30,36-37H,4-14H2,1-3H3