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(1-methylquinolin-1-ium-6-yl) 4-hexoxy-3,5-dimethoxy-benzoate

(1-methylquinolin-1-ium-6-yl) 4-hexoxy-3,5-dimethoxy-benzoate

Systemtic Name:(1-methylquinolin-1-ium-6-yl) 4-hexoxy-3,5-dimethoxy-benzoate
Openeye Name:(1-methylquinolin-1-ium-6-yl) 4-hexoxy-3,5-dimethoxy-benzoate
CAS Name:4-hexoxy-3,5-dimethoxybenzoic acid (1-methyl-6-quinolin-1-iumyl) ester
IUPAC Name:(1-methylquinolin-1-ium-6-yl) 4-hexoxy-3,5-dimethoxybenzoate
Traditional Name:4-hexoxy-3,5-dimethoxy-benzoic acid (1-methylquinolin-1-ium-6-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=CC3=C(C=C2)[N+](=CC=C3)C)OC


Isomeric SMILES

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


InChI

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


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