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

Systemtic Name: 2-azanyl-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanoic acid Openeye Name: 2-amino-4-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]butanoic acid CAS Name: 2-amino-4-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]butanoic acid IUPAC Name: 2-amino-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]butanoic acid Traditional Name: 2-amino-4-(naphthionylamino)butyric acid Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCC(C(=O)O)N

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCC(C(=O)O)N

InChI

InChI=1S/C16H21N3O4S/c1-19(2)14-7-3-6-12-11(14)5-4-8-15(12)24(22,23)18-10-9-13(17)16(20)21/h3-8,13,18H,9-10,17H2,1-2H3,(H,20,21)