(2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-methylbutanoic acid Traditional Name: (2R)-3-methyl-2-(naphthionylamino)butyric acid Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

Isomeric SMILES

CC(C)[C@H](C(=O)O)NS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C

InChI

InChI=1S/C17H22N2O4S/c1-11(2)16(17(20)21)18-24(22,23)15-10-6-7-12-13(15)8-5-9-14(12)19(3)4/h5-11,16,18H,1-4H3,(H,20,21)/t16-/m1/s1