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

Systemtic Name: 4-azido-N-[5-(hydroxymethyl)-8-pyridin-3-yl-octyl]benzenesulfonamide Openeye Name: 4-azido-N-[5-(hydroxymethyl)-8-(3-pyridyl)octyl]benzenesulfonamide CAS Name: 4-azido-N-[5-(hydroxymethyl)-8-(3-pyridinyl)octyl]benzenesulfonamide IUPAC Name: 4-azido-N-[5-(hydroxymethyl)-8-pyridin-3-yloctyl]benzenesulfonamide Traditional Name: 4-azido-N-[5-methylol-8-(3-pyridyl)octyl]benzenesulfonamide Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)N=[N+]=[N-])CO

Isomeric SMILES

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)N=[N+]=[N-])CO

InChI

InChI=1S/C20H27N5O3S/c21-25-24-19-9-11-20(12-10-19)29(27,28)23-14-2-1-5-18(16-26)7-3-6-17-8-4-13-22-15-17/h4,8-13,15,18,23,26H,1-3,5-7,14,16H2