1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(4-methylphenyl)methylsulfonyl]propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(4-methylphenyl)methylsulfonyl]propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(p-tolylmethylsulfonyl)propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(4-methylphenyl)methylsulfonyl]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[(4-methylphenyl)methylsulfonyl]propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-methylbenzyl)sulfonyl-propan-1-one Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)CCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H23NO3S/c1-16-6-8-17(9-7-16)15-25(23,24)13-11-20(22)21-12-10-18-4-2-3-5-19(18)14-21/h2-9H,10-15H2,1H3