diethyl-[2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbothioylamino]ethyl]-methyl-azanium iodide

Systemtic Name: diethyl-[2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbothioylamino]ethyl]-methyl-azanium iodide Openeye Name: diethyl-[2-[(8-methoxy-2-oxo-chromene-3-carbothioyl)amino]ethyl]-methyl-ammonium iodide CAS Name: diethyl-[2-[[(8-methoxy-2-oxo-1-benzopyran-3-yl)-sulfanylidenemethyl]amino]ethyl]-methylammonium iodide IUPAC Name: diethyl-[2-[(8-methoxy-2-oxochromene-3-carbothioyl)amino]ethyl]-methylazanium iodide Traditional Name: diethyl-[2-[(2-keto-8-methoxy-chromene-3-carbothioyl)amino]ethyl]-methyl-ammonium iodide Formula: C18H25IN2O3S MolecularWeight: 476.37217

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCNC(=S)C1=CC2=C(C(=CC=C2)OC)OC1=O.[I-]

Isomeric SMILES

CC[N+](C)(CC)CCNC(=S)C1=CC2=C(C(=CC=C2)OC)OC1=O.[I-]

InChI

InChI=1S/C18H24N2O3S.HI/c1-5-20(3,6-2)11-10-19-17(24)14-12-13-8-7-9-15(22-4)16(13)23-18(14)21;/h7-9,12H,5-6,10-11H2,1-4H3;1H