5-[4-(2-methoxyphenyl)piperidin-1-yl]sulfonylisoquinoline

Systemtic Name: 5-[4-(2-methoxyphenyl)piperidin-1-yl]sulfonylisoquinoline Openeye Name: 5-[[4-(2-methoxyphenyl)-1-piperidyl]sulfonyl]isoquinoline CAS Name: 5-[[4-(2-methoxyphenyl)-1-piperidinyl]sulfonyl]isoquinoline IUPAC Name: 5-[4-(2-methoxyphenyl)piperidin-1-yl]sulfonylisoquinoline Traditional Name: 5-[4-(2-methoxyphenyl)piperidino]sulfonylisoquinoline Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

COC1=CC=CC=C1C2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H22N2O3S/c1-26-20-7-3-2-6-18(20)16-10-13-23(14-11-16)27(24,25)21-8-4-5-17-15-22-12-9-19(17)21/h2-9,12,15-16H,10-11,13-14H2,1H3