[2-(tert-butylamino)-2-oxidanylidene-ethyl]-(7-chloranylquinolin-4-yl)azanium chloride

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-(7-chloranylquinolin-4-yl)azanium chloride Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-(7-chloro-4-quinolyl)ammonium chloride CAS Name: [2-(tert-butylamino)-2-oxoethyl]-(7-chloro-4-quinolinyl)ammonium chloride IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-(7-chloroquinolin-4-yl)azanium chloride Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-(7-chloro-4-quinolyl)ammonium chloride Formula: C15H19Cl2N3O MolecularWeight: 328.23686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH2+]C1=C2C=CC(=CC2=NC=C1)Cl.[Cl-]

Isomeric SMILES

CC(C)(C)NC(=O)C[NH2+]C1=C2C=CC(=CC2=NC=C1)Cl.[Cl-]

InChI

InChI=1S/C15H18ClN3O.ClH/c1-15(2,3)19-14(20)9-18-12-6-7-17-13-8-10(16)4-5-11(12)13;/h4-8H,9H2,1-3H3,(H,17,18)(H,19,20);1H