N-(2-oxidanylpropyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(2-oxidanylpropyl)isoquinoline-5-sulfonamide Openeye Name: N-(2-hydroxypropyl)isoquinoline-5-sulfonamide CAS Name: N-(2-hydroxypropyl)-5-isoquinolinesulfonamide IUPAC Name: N-(2-hydroxypropyl)isoquinoline-5-sulfonamide Traditional Name: N-(2-hydroxypropyl)isoquinoline-5-sulfonamide Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)O

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)O

InChI

InChI=1S/C12H14N2O3S/c1-9(15)7-14-18(16,17)12-4-2-3-10-8-13-6-5-11(10)12/h2-6,8-9,14-15H,7H2,1H3