(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2S)-1-tosylpyrrolidin-2-yl]methanone Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C23H28N2O5S/c1-16-6-8-19(9-7-16)31(27,28)25-11-4-5-20(25)23(26)24-12-10-17-13-21(29-2)22(30-3)14-18(17)15-24/h6-9,13-14,20H,4-5,10-12,15H2,1-3H3/t20-/m0/s1