2-(2,6-dimethoxyphenyl)sulfonyl-8a-(phenylmethyl)-3,4,7,8-tetrahydro-1H-isoquinolin-6-one

Systemtic Name: 2-(2,6-dimethoxyphenyl)sulfonyl-8a-(phenylmethyl)-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Openeye Name: 8a-benzyl-2-(2,6-dimethoxyphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-6-one CAS Name: 2-(2,6-dimethoxyphenyl)sulfonyl-8a-(phenylmethyl)-3,4,7,8-tetrahydro-1H-isoquinolin-6-one IUPAC Name: 8a-benzyl-2-(2,6-dimethoxyphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Traditional Name: 8a-benzyl-2-(2,6-dimethoxyphenyl)sulfonyl-3,4,7,8-tetrahydro-1H-isoquinolin-6-one Formula: C24H27NO5S MolecularWeight: 441.53988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)S(=O)(=O)N2CCC3=CC(=O)CCC3(C2)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC=C1)OC)S(=O)(=O)N2CCC3=CC(=O)CCC3(C2)CC4=CC=CC=C4

InChI

InChI=1S/C24H27NO5S/c1-29-21-9-6-10-22(30-2)23(21)31(27,28)25-14-12-19-15-20(26)11-13-24(19,17-25)16-18-7-4-3-5-8-18/h3-10,15H,11-14,16-17H2,1-2H3