butyl-[2-(diethylazaniumyl)ethyl]-naphthalen-1-ylcarbonyl-azanium; 2-(carboxymethyl)-2-oxidanyl-butanedioate

Systemtic Name: butyl-[2-(diethylazaniumyl)ethyl]-naphthalen-1-ylcarbonyl-azanium; 2-(carboxymethyl)-2-oxidanyl-butanedioate Openeye Name: butyl-[2-(diethylammonio)ethyl]-(naphthalene-1-carbonyl)ammonium; 2-(carboxymethyl)-2-hydroxy-butanedioate CAS Name: butyl-[2-(diethylammonio)ethyl]-[1-naphthalenyl(oxo)methyl]ammonium; 2-(carboxymethyl)-2-hydroxybutanedioate IUPAC Name: butyl-[2-(diethylazaniumyl)ethyl]-(naphthalene-1-carbonyl)azanium; 2-(carboxymethyl)-2-hydroxybutanedioate Traditional Name: butyl-[2-(diethylammonio)ethyl]-(1-naphthoyl)ammonium; 2-(carboxymethyl)-2-hydroxy-succinate Formula: C27H38N2O8 MolecularWeight: 518.59922

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC[NH+](CC)CC)C(=O)C1=CC=CC2=CC=CC=C21.C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCCC[NH+](CC[NH+](CC)CC)C(=O)C1=CC=CC2=CC=CC=C21.C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C21H30N2O.C6H8O7/c1-4-7-15-23(17-16-22(5-2)6-3)21(24)20-14-10-12-18-11-8-9-13-19(18)20;7-3(8)1-6(13,5(11)12)2-4(9)10/h8-14H,4-7,15-17H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)