1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol

Systemtic Name: 1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol Openeye Name: 1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol CAS Name: 1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol IUPAC Name: 1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol Traditional Name: 1-butyl-2-methyl-3,4-dihydroisoquinolin-2-ium-6,7-diol Formula: C14H20NO2+ MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](CCC2=CC(=C(C=C21)O)O)C

Isomeric SMILES

CCCCC1=[N+](CCC2=CC(=C(C=C21)O)O)C

InChI

InChI=1S/C14H19NO2/c1-3-4-5-12-11-9-14(17)13(16)8-10(11)6-7-15(12)2/h8-9,17H,3-7H2,1-2H3/p+1