1-[3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)piperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[3-[[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidino]sulfonylphenyl]ethanone Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H26N2O4S/c1-17(26)20-7-4-8-22(15-20)30(28,29)25-13-10-19(11-14-25)23(27)24-12-9-18-5-2-3-6-21(18)16-24/h2-8,15,19H,9-14,16H2,1H3