diethyl-[2-[[2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]azaniumyl]ethyl]azanium; dihydrogen phosphate

Systemtic Name: diethyl-[2-[[2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]azaniumyl]ethyl]azanium; dihydrogen phosphate Openeye Name: diethyl-[2-[[2-(1-naphthyl)-3-tetrahydrofuran-2-yl-propyl]ammonio]ethyl]ammonium; dihydrogen phosphate CAS Name: diethyl-[2-[[2-(1-naphthalenyl)-3-(2-oxolanyl)propyl]ammonio]ethyl]ammonium; dihydrogen phosphate IUPAC Name: diethyl-[2-[[2-naphthalen-1-yl-3-(oxolan-2-yl)propyl]azaniumyl]ethyl]azanium; dihydrogen phosphate Traditional Name: diethyl-[2-[[2-(1-naphthyl)-3-(tetrahydrofuryl)propyl]ammonio]ethyl]ammonium; dihydrogen phosphate Formula: C23H40N2O9P2 MolecularWeight: 550.519222

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH2+]CC(CC1CCCO1)C2=CC=CC3=CC=CC=C32.OP(=O)(O)[O-].OP(=O)(O)[O-]

Isomeric SMILES

CC[NH+](CC)CC[NH2+]CC(CC1CCCO1)C2=CC=CC3=CC=CC=C32.OP(=O)(O)[O-].OP(=O)(O)[O-]

InChI

InChI=1S/C23H34N2O.2H3O4P/c1-3-25(4-2)15-14-24-18-20(17-21-11-8-16-26-21)23-13-7-10-19-9-5-6-12-22(19)23;2*1-5(2,3)4/h5-7,9-10,12-13,20-21,24H,3-4,8,11,14-18H2,1-2H3;2*(H3,1,2,3,4)