8-chloranyl-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]quinoline-5-sulfonamide

Systemtic Name: 8-chloranyl-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]quinoline-5-sulfonamide Openeye Name: 8-chloro-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]quinoline-5-sulfonamide CAS Name: 8-chloro-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]-5-quinolinesulfonamide IUPAC Name: 8-chloro-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]ethyl]quinoline-5-sulfonamide Traditional Name: 8-chloro-N-[2-(homoveratrylamino)ethyl]quinoline-5-sulfonamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCNS(=O)(=O)C2=C3C=CC=NC3=C(C=C2)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCNS(=O)(=O)C2=C3C=CC=NC3=C(C=C2)Cl)OC

InChI

InChI=1S/C21H24ClN3O4S/c1-28-18-7-5-15(14-19(18)29-2)9-11-23-12-13-25-30(26,27)20-8-6-17(22)21-16(20)4-3-10-24-21/h3-8,10,14,23,25H,9,11-13H2,1-2H3