1,2-dihydroisoquinolin-4-ylmethyl phenylmethanesulfonate

Systemtic Name: 1,2-dihydroisoquinolin-4-ylmethyl phenylmethanesulfonate Openeye Name: 1,2-dihydroisoquinolin-4-ylmethyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid 1,2-dihydroisoquinolin-4-ylmethyl ester IUPAC Name: 1,2-dihydroisoquinolin-4-ylmethyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid 1,2-dihydroisoquinolin-4-ylmethyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=CN1)COS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2C(=CN1)COS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H17NO3S/c19-22(20,13-14-6-2-1-3-7-14)21-12-16-11-18-10-15-8-4-5-9-17(15)16/h1-9,11,18H,10,12-13H2