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(1-methylquinolin-1-ium-8-yl) 4-hexoxy-3,5-dimethoxy-benzoate

(1-methylquinolin-1-ium-8-yl) 4-hexoxy-3,5-dimethoxy-benzoate

Systemtic Name:(1-methylquinolin-1-ium-8-yl) 4-hexoxy-3,5-dimethoxy-benzoate
Openeye Name:(1-methylquinolin-1-ium-8-yl) 4-hexoxy-3,5-dimethoxy-benzoate
CAS Name:4-hexoxy-3,5-dimethoxybenzoic acid (1-methyl-8-quinolin-1-iumyl) ester
IUPAC Name:(1-methylquinolin-1-ium-8-yl) 4-hexoxy-3,5-dimethoxybenzoate
Traditional Name:4-hexoxy-3,5-dimethoxy-benzoic acid (1-methylquinolin-1-ium-8-yl) ester
Formula: C25H30NO5+
MolecularWeight: 424.5094
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1OC)C(=O)OC2=CC=CC3=C2[N+](=CC=C3)C)OC


Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1OC)C(=O)OC2=CC=CC3=C2[N+](=CC=C3)C)OC


InChI

InChI=1S/C25H30NO5/c1-5-6-7-8-15-30-24-21(28-3)16-19(17-22(24)29-4)25(27)31-20-13-9-11-18-12-10-14-26(2)23(18)20/h9-14,16-17H,5-8,15H2,1-4H3/q+1


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