2-(6-chloranyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethyl-azanium chloride

Systemtic Name: 2-(6-chloranyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethyl-azanium chloride Openeye Name: 2-(6-chloro-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethyl-ammonium chloride CAS Name: 2-(6-chloro-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethylammonium chloride IUPAC Name: 2-(6-chloro-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethylazanium chloride Traditional Name: 2-(6-chloro-3-keto-2-phenyl-1,4-benzoxazin-4-yl)ethyl-diethyl-ammonium chloride Formula: C20H24Cl2N2O2 MolecularWeight: 395.32276

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=C(C=CC(=C2)Cl)OC(C1=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCN1C2=C(C=CC(=C2)Cl)OC(C1=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H23ClN2O2.ClH/c1-3-22(4-2)12-13-23-17-14-16(21)10-11-18(17)25-19(20(23)24)15-8-6-5-7-9-15;/h5-11,14,19H,3-4,12-13H2,1-2H3;1H