N-[1-[4-(4-methoxyphenoxy)butyl]piperidin-4-yl]-N-methyl-isoquinoline-5-sulfonamide

Systemtic Name: N-[1-[4-(4-methoxyphenoxy)butyl]piperidin-4-yl]-N-methyl-isoquinoline-5-sulfonamide Openeye Name: N-[1-[4-(4-methoxyphenoxy)butyl]-4-piperidyl]-N-methyl-isoquinoline-5-sulfonamide CAS Name: N-[1-[4-(4-methoxyphenoxy)butyl]-4-piperidinyl]-N-methyl-5-isoquinolinesulfonamide IUPAC Name: N-[1-[4-(4-methoxyphenoxy)butyl]piperidin-4-yl]-N-methylisoquinoline-5-sulfonamide Traditional Name: N-[1-[4-(4-methoxyphenoxy)butyl]-4-piperidyl]-N-methyl-isoquinoline-5-sulfonamide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CCCCOC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CN(C1CCN(CC1)CCCCOC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C26H33N3O4S/c1-28(34(30,31)26-7-5-6-21-20-27-15-12-25(21)26)22-13-17-29(18-14-22)16-3-4-19-33-24-10-8-23(32-2)9-11-24/h5-12,15,20,22H,3-4,13-14,16-19H2,1-2H3