(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(3,5-dimethylpiperidino)sulfonylphenyl]methanone Formula: C25H32N2O5S MolecularWeight: 472.59698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C

InChI

InChI=1S/C25H32N2O5S/c1-17-11-18(2)15-27(14-17)33(29,30)22-7-5-19(6-8-22)25(28)26-10-9-20-12-23(31-3)24(32-4)13-21(20)16-26/h5-8,12-13,17-18H,9-11,14-16H2,1-4H3