5-chloranyl-2-methyl-8-oxidanyl-N-(4-phenylbutyl)quinoline-7-sulfonamide

Systemtic Name: 5-chloranyl-2-methyl-8-oxidanyl-N-(4-phenylbutyl)quinoline-7-sulfonamide Openeye Name: 5-chloro-8-hydroxy-2-methyl-N-(4-phenylbutyl)quinoline-7-sulfonamide CAS Name: 5-chloro-8-hydroxy-2-methyl-N-(4-phenylbutyl)-7-quinolinesulfonamide IUPAC Name: 5-chloro-8-hydroxy-2-methyl-N-(4-phenylbutyl)quinoline-7-sulfonamide Traditional Name: 5-chloro-8-hydroxy-2-methyl-N-(4-phenylbutyl)quinoline-7-sulfonamide Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)(=O)NCCCCC3=CC=CC=C3)O

Isomeric SMILES

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)(=O)NCCCCC3=CC=CC=C3)O

InChI

InChI=1S/C20H21ClN2O3S/c1-14-10-11-16-17(21)13-18(20(24)19(16)23-14)27(25,26)22-12-6-5-9-15-7-3-2-4-8-15/h2-4,7-8,10-11,13,22,24H,5-6,9,12H2,1H3