6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol; 2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol; 2-oxidanyl-2-phenyl-ethanoate Openeye Name: 2-hydroxy-2-phenyl-acetate; 6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol CAS Name: 2-hydroxy-2-phenylacetate; 6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol IUPAC Name: 2-hydroxy-2-phenylacetate; 6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Traditional Name: 2-hydroxy-2-phenyl-acetate; 6-methoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-ol Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CC[NH+]1C)OC)O.C1=CC=C(C=C1)C(C(=O)[O-])O

Isomeric SMILES

CC1C2=CC(=C(C=C2CC[NH+]1C)OC)O.C1=CC=C(C=C1)C(C(=O)[O-])O

InChI

InChI=1S/C12H17NO2.C8H8O3/c1-8-10-7-11(14)12(15-3)6-9(10)4-5-13(8)2;9-7(8(10)11)6-4-2-1-3-5-6/h6-8,14H,4-5H2,1-3H3;1-5,7,9H,(H,10,11)