potassium [(Z)-[8-chloranyl-1-(2,2-dimethylpropanoyl)-2,3-dihydroquinolin-4-ylidene]amino] sulfate

Systemtic Name: potassium [(Z)-[8-chloranyl-1-(2,2-dimethylpropanoyl)-2,3-dihydroquinolin-4-ylidene]amino] sulfate Openeye Name: potassium [(Z)-[8-chloro-1-(2,2-dimethylpropanoyl)-2,3-dihydroquinolin-4-ylidene]amino] sulfate CAS Name: potassium [(Z)-[8-chloro-1-(2,2-dimethyl-1-oxopropyl)-2,3-dihydroquinolin-4-ylidene]amino] sulfate IUPAC Name: potassium [(Z)-[8-chloro-1-(2,2-dimethylpropanoyl)-2,3-dihydroquinolin-4-ylidene]amino] sulfate Traditional Name: potassium [(Z)-(8-chloro-1-pivaloyl-2,3-dihydroquinolin-4-ylidene)amino] sulfate Formula: C14H16ClKN2O5S MolecularWeight: 398.90354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(=NOS(=O)(=O)[O-])C2=C1C(=CC=C2)Cl.[K+]

Isomeric SMILES

CC(C)(C)C(=O)N1CC/C(=N/OS(=O)(=O)[O-])/C2=C1C(=CC=C2)Cl.[K+]

InChI

InChI=1S/C14H17ClN2O5S.K/c1-14(2,3)13(18)17-8-7-11(16-22-23(19,20)21)9-5-4-6-10(15)12(9)17;/h4-6H,7-8H2,1-3H3,(H,19,20,21);/q;+1/p-1/b16-11-;