N-[[1-[2-(3H-inden-1-yl)ethyl]-4-oxidanyl-piperidin-4-yl]methyl]-N-methyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[[1-[2-(3H-inden-1-yl)ethyl]-4-oxidanyl-piperidin-4-yl]methyl]-N-methyl-isoquinoline-5-sulfonamide Openeye Name: N-[[4-hydroxy-1-[2-(3H-inden-1-yl)ethyl]-4-piperidyl]methyl]-N-methyl-isoquinoline-5-sulfonamide CAS Name: N-[[4-hydroxy-1-[2-(3H-inden-1-yl)ethyl]-4-piperidinyl]methyl]-N-methyl-5-isoquinolinesulfonamide IUPAC Name: N-[[4-hydroxy-1-[2-(3H-inden-1-yl)ethyl]piperidin-4-yl]methyl]-N-methylisoquinoline-5-sulfonamide Traditional Name: N-[[4-hydroxy-1-[2-(3H-inden-1-yl)ethyl]-4-piperidyl]methyl]-N-methyl-isoquinoline-5-sulfonamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1(CCN(CC1)CCC2=CCC3=CC=CC=C32)O)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

CN(CC1(CCN(CC1)CCC2=CCC3=CC=CC=C32)O)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C27H31N3O3S/c1-29(34(32,33)26-8-4-6-23-19-28-15-11-25(23)26)20-27(31)13-17-30(18-14-27)16-12-22-10-9-21-5-2-3-7-24(21)22/h2-8,10-11,15,19,31H,9,12-14,16-18,20H2,1H3