2-[(4-chlorophenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(4-chlorophenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(4-chlorophenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(4-chlorophenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(4-chlorophenyl)methylsulfonyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-chlorobenzyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H16ClNO2S MolecularWeight: 321.82174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H16ClNO2S/c17-16-7-5-13(6-8-16)12-21(19,20)18-10-9-14-3-1-2-4-15(14)11-18/h1-8H,9-12H2