[1-(2-carboxy-1-methyl-pyrrolidin-1-ium-1-yl)-2-methyl-1-oxidanylidene-propan-2-yl]-dimethyl-(2-methyl-1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)azanium

Systemtic Name: [1-(2-carboxy-1-methyl-pyrrolidin-1-ium-1-yl)-2-methyl-1-oxidanylidene-propan-2-yl]-dimethyl-(2-methyl-1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)azanium Openeye Name: (1-carboxy-1-methyl-3-phenyl-propyl)-[2-(2-carboxy-1-methyl-pyrrolidin-1-ium-1-yl)-1,1-dimethyl-2-oxo-ethyl]-dimethyl-ammonium CAS Name: [1-(2-carboxy-1-methyl-1-pyrrolidin-1-iumyl)-2-methyl-1-oxopropan-2-yl]-(1-hydroxy-2-methyl-1-oxo-4-phenylbutan-2-yl)-dimethylammonium IUPAC Name: [1-(2-carboxy-1-methylpyrrolidin-1-ium-1-yl)-2-methyl-1-oxopropan-2-yl]-(1-hydroxy-2-methyl-1-oxo-4-phenylbutan-2-yl)-dimethylazanium Traditional Name: (1-carboxy-1-methyl-3-phenyl-propyl)-[2-(2-carboxy-1-methyl-pyrrolidin-1-ium-1-yl)-2-keto-1,1-dimethyl-ethyl]-dimethyl-ammonium Formula: C23H36N2O5+2 MolecularWeight: 420.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[N+]1(CCCC1C(=O)O)C)[N+](C)(C)C(C)(CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C(=O)[N+]1(CCCC1C(=O)O)C)[N+](C)(C)C(C)(CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C23H34N2O5/c1-22(2,20(28)25(6)16-10-13-18(25)19(26)27)24(4,5)23(3,21(29)30)15-14-17-11-8-7-9-12-17/h7-9,11-12,18H,10,13-16H2,1-6H3/p+2