N-[5-(3-azanylbutyl)-2,3-dimethoxy-phenyl]methanesulfonamide

Systemtic Name: N-[5-(3-azanylbutyl)-2,3-dimethoxy-phenyl]methanesulfonamide Openeye Name: N-[5-(3-aminobutyl)-2,3-dimethoxy-phenyl]methanesulfonamide CAS Name: N-[5-(3-aminobutyl)-2,3-dimethoxyphenyl]methanesulfonamide IUPAC Name: N-[5-(3-aminobutyl)-2,3-dimethoxyphenyl]methanesulfonamide Traditional Name: N-[5-(3-aminobutyl)-2,3-dimethoxy-phenyl]methanesulfonamide Formula: C13H22N2O4S MolecularWeight: 302.38978

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=C(C(=C1)OC)OC)NS(=O)(=O)C)N

Isomeric SMILES

CC(CCC1=CC(=C(C(=C1)OC)OC)NS(=O)(=O)C)N

InChI

InChI=1S/C13H22N2O4S/c1-9(14)5-6-10-7-11(15-20(4,16)17)13(19-3)12(8-10)18-2/h7-9,15H,5-6,14H2,1-4H3