2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(diethoxyphosphorylmethyl)-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C15H25NO4P+ MolecularWeight: 314.337061

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C[NH+]1CCC2=C(C1)C=C(C=C2)OC)OCC

Isomeric SMILES

CCOP(=O)(C[NH+]1CCC2=C(C1)C=C(C=C2)OC)OCC

InChI

InChI=1S/C15H24NO4P/c1-4-19-21(17,20-5-2)12-16-9-8-13-6-7-15(18-3)10-14(13)11-16/h6-7,10H,4-5,8-9,11-12H2,1-3H3/p+1