butyl-[2-(diethylazaniumyl)ethyl]-naphthalen-1-ylcarbonyl-azanium; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: butyl-[2-(diethylazaniumyl)ethyl]-naphthalen-1-ylcarbonyl-azanium; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: butyl-[2-(diethylammonio)ethyl]-(naphthalene-1-carbonyl)ammonium; citric acid CAS Name: butyl-[2-(diethylammonio)ethyl]-[1-naphthalenyl(oxo)methyl]ammonium; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: butyl-[2-(diethylazaniumyl)ethyl]-(naphthalene-1-carbonyl)azanium; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: butyl-[2-(diethylammonio)ethyl]-(1-naphthoyl)ammonium; citric acid Formula: C27H40N2O8+2 MolecularWeight: 520.6151

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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)/p+2