N-[4-[3-[methyl(quinolin-2-ylmethyl)amino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-[methyl(quinolin-2-ylmethyl)amino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide Openeye Name: N-[4-[2-hydroxy-3-[methyl(2-quinolylmethyl)amino]propoxy]phenyl]methanesulfonamide CAS Name: N-[4-[2-hydroxy-3-[methyl(2-quinolinylmethyl)amino]propoxy]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-hydroxy-3-[methyl(quinolin-2-ylmethyl)amino]propoxy]phenyl]methanesulfonamide Traditional Name: N-[4-[2-hydroxy-3-[methyl(2-quinolylmethyl)amino]propoxy]phenyl]methanesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2C=C1)CC(COC3=CC=C(C=C3)NS(=O)(=O)C)O

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2C=C1)CC(COC3=CC=C(C=C3)NS(=O)(=O)C)O

InChI

InChI=1S/C21H25N3O4S/c1-24(13-18-8-7-16-5-3-4-6-21(16)22-18)14-19(25)15-28-20-11-9-17(10-12-20)23-29(2,26)27/h3-12,19,23,25H,13-15H2,1-2H3