1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethyl-piperidin-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethyl-piperidin-1-ium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethyl-piperidin-1-ium; 2-hydroxy-2-oxo-acetate CAS Name: 1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethylpiperidin-1-ium; 2-hydroxy-2-oxoacetate IUPAC Name: 1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethylpiperidin-1-ium; 2-hydroxy-2-oxoacetate Traditional Name: 1-[4-(3,4-dihydronaphthalen-1-yl)butyl]-3,3-dimethyl-piperidin-1-ium binoxalate Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC[NH+](C1)CCCCC2=CCCC3=CC=CC=C32)C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1(CCC[NH+](C1)CCCCC2=CCCC3=CC=CC=C32)C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C21H31N.C2H2O4/c1-21(2)14-8-16-22(17-21)15-6-5-10-19-12-7-11-18-9-3-4-13-20(18)19;3-1(4)2(5)6/h3-4,9,12-13H,5-8,10-11,14-17H2,1-2H3;(H,3,4)(H,5,6)