6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C[NH2+]CCC2=C1)OCC

Isomeric SMILES

CCOC1=C(C=C2C[NH2+]CCC2=C1)OCC

InChI

InChI=1S/C13H19NO2/c1-3-15-12-7-10-5-6-14-9-11(10)8-13(12)16-4-2/h7-8,14H,3-6,9H2,1-2H3/p+1