1,2,3,4-tetrahydroisoquinolin-3-ylmethyl hydrogen sulfate

Systemtic Name: 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl hydrogen sulfate Openeye Name: 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl hydrogen sulfate CAS Name: sulfuric acid 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl ester IUPAC Name: 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl hydrogen sulfate Traditional Name: sulfuric acid 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl ester Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=CC=CC=C21)COS(=O)(=O)O

Isomeric SMILES

C1C(NCC2=CC=CC=C21)COS(=O)(=O)O

InChI

InChI=1S/C10H13NO4S/c12-16(13,14)15-7-10-5-8-3-1-2-4-9(8)6-11-10/h1-4,10-11H,5-7H2,(H,12,13,14)