1-[(4-hydroxyphenyl)methyl]-N-methyl-3-[2-(4-oxidanylpiperidin-1-yl)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: 1-[(4-hydroxyphenyl)methyl]-N-methyl-3-[2-(4-oxidanylpiperidin-1-yl)ethyl]isoquinoline-5-sulfonamide Openeye Name: 1-[(4-hydroxyphenyl)methyl]-3-[2-(4-hydroxy-1-piperidyl)ethyl]-N-methyl-isoquinoline-5-sulfonamide CAS Name: 1-[(4-hydroxyphenyl)methyl]-3-[2-(4-hydroxy-1-piperidinyl)ethyl]-N-methyl-5-isoquinolinesulfonamide IUPAC Name: 1-[(4-hydroxyphenyl)methyl]-3-[2-(4-hydroxypiperidin-1-yl)ethyl]-N-methylisoquinoline-5-sulfonamide Traditional Name: 1-(4-hydroxybenzyl)-3-[2-(4-hydroxypiperidino)ethyl]-N-methyl-isoquinoline-5-sulfonamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC2=C(N=C(C=C21)CCN3CCC(CC3)O)CC4=CC=C(C=C4)O

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC2=C(N=C(C=C21)CCN3CCC(CC3)O)CC4=CC=C(C=C4)O

InChI

InChI=1S/C24H29N3O4S/c1-25-32(30,31)24-4-2-3-21-22(24)16-18(9-12-27-13-10-20(29)11-14-27)26-23(21)15-17-5-7-19(28)8-6-17/h2-8,16,20,25,28-29H,9-15H2,1H3