N-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-8-chloranyl-quinoline-5-sulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-8-chloranyl-quinoline-5-sulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-8-chloro-quinoline-5-sulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-8-chloro-5-quinolinesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-8-chloroquinoline-5-sulfonamide Traditional Name: 8-chloro-N-[2-(piperonylamino)ethyl]quinoline-5-sulfonamide Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCCNS(=O)(=O)C3=C4C=CC=NC4=C(C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCCNS(=O)(=O)C3=C4C=CC=NC4=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O4S/c20-15-4-6-18(14-2-1-7-22-19(14)15)28(24,25)23-9-8-21-11-13-3-5-16-17(10-13)27-12-26-16/h1-7,10,21,23H,8-9,11-12H2