2-[[10-(2-diethylaminoethyloxycarbonyl)-9,10-dihydroanthracen-9-yl]carbonyloxy]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[[10-(2-diethylaminoethyloxycarbonyl)-9,10-dihydroanthracen-9-yl]carbonyloxy]ethyl-diethyl-azanium chloride Openeye Name: 2-[10-(2-diethylaminoethyloxycarbonyl)-9,10-dihydroanthracene-9-carbonyl]oxyethyl-diethyl-ammonium chloride CAS Name: 2-[[10-[2-diethylaminoethyloxy(oxo)methyl]-9,10-dihydroanthracen-9-yl]-oxomethoxy]ethyl-diethylammonium chloride IUPAC Name: 2-[10-(2-diethylaminoethyloxycarbonyl)-9,10-dihydroanthracene-9-carbonyl]oxyethyl-diethylazanium chloride Traditional Name: 2-[10-(2-diethylaminoethyloxycarbonyl)-9,10-dihydroanthracene-9-carbonyl]oxyethyl-diethyl-ammonium chloride Formula: C28H39ClN2O4 MolecularWeight: 503.07326

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1C2=CC=CC=C2C(C3=CC=CC=C13)C(=O)OCCN(CC)CC.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1C2=CC=CC=C2C(C3=CC=CC=C13)C(=O)OCCN(CC)CC.[Cl-]

InChI

InChI=1S/C28H38N2O4.ClH/c1-5-29(6-2)17-19-33-27(31)25-21-13-9-11-15-23(21)26(24-16-12-10-14-22(24)25)28(32)34-20-18-30(7-3)8-4;/h9-16,25-26H,5-8,17-20H2,1-4H3;1H