2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfinyl-butanoic acid

Systemtic Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfinyl-butanoic acid Openeye Name: 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-4-methylsulfinyl-butanoic acid CAS Name: 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-4-methylsulfinylbutanoic acid IUPAC Name: 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfinylbutanoic acid Traditional Name: 4-methylsulfinyl-2-(naphthionylamino)butyric acid Formula: C17H22N2O5S2 MolecularWeight: 398.49698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CCS(=O)C)C(=O)O

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CCS(=O)C)C(=O)O

InChI

InChI=1S/C17H22N2O5S2/c1-19(2)15-8-4-7-13-12(15)6-5-9-16(13)26(23,24)18-14(17(20)21)10-11-25(3)22/h4-9,14,18H,10-11H2,1-3H3,(H,20,21)