potassium 5-(3-oxidanylidenebutanoylamino)naphthalene-1-sulfonate

Systemtic Name: potassium 5-(3-oxidanylidenebutanoylamino)naphthalene-1-sulfonate Openeye Name: potassium 5-(3-oxobutanoylamino)naphthalene-1-sulfonate CAS Name: potassium 5-(1,3-dioxobutylamino)-1-naphthalenesulfonate IUPAC Name: potassium 5-(3-oxobutanoylamino)naphthalene-1-sulfonate Traditional Name: potassium 5-(acetoacetylamino)naphthalene-1-sulfonate Formula: C14H12KNO5S MolecularWeight: 345.41208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC1=CC=CC2=C1C=CC=C2S(=O)(=O)[O-].[K+]

Isomeric SMILES

CC(=O)CC(=O)NC1=CC=CC2=C1C=CC=C2S(=O)(=O)[O-].[K+]

InChI

InChI=1S/C14H13NO5S.K/c1-9(16)8-14(17)15-12-6-2-5-11-10(12)4-3-7-13(11)21(18,19)20;/h2-7H,8H2,1H3,(H,15,17)(H,18,19,20);/q;+1/p-1