N-[5-(hydroxymethyl)-8-pyridin-3-yl-octyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[5-(hydroxymethyl)-8-pyridin-3-yl-octyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[5-(hydroxymethyl)-8-(3-pyridyl)octyl]-4-methoxy-benzenesulfonamide CAS Name: N-[5-(hydroxymethyl)-8-(3-pyridinyl)octyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[5-(hydroxymethyl)-8-pyridin-3-yloctyl]-4-methoxybenzenesulfonamide Traditional Name: 4-methoxy-N-[5-methylol-8-(3-pyridyl)octyl]benzenesulfonamide Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCCCCC(CCCC2=CN=CC=C2)CO

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCCCCC(CCCC2=CN=CC=C2)CO

InChI

InChI=1S/C21H30N2O4S/c1-27-20-10-12-21(13-11-20)28(25,26)23-15-3-2-6-19(17-24)8-4-7-18-9-5-14-22-16-18/h5,9-14,16,19,23-24H,2-4,6-8,15,17H2,1H3