[azanyl-[[2-ethoxy-5-(2-methoxy-2-oxidanylidene-ethyl)phenyl]methylsulfanyl]methylidene]azanium chloride

Systemtic Name: [azanyl-[[2-ethoxy-5-(2-methoxy-2-oxidanylidene-ethyl)phenyl]methylsulfanyl]methylidene]azanium chloride Openeye Name: [amino-[[2-ethoxy-5-(2-methoxy-2-oxo-ethyl)phenyl]methylsulfanyl]methylene]ammonium chloride CAS Name: [amino-[[2-ethoxy-5-(2-methoxy-2-oxoethyl)phenyl]methylthio]methylidene]ammonium chloride IUPAC Name: [amino-[[2-ethoxy-5-(2-methoxy-2-oxoethyl)phenyl]methylsulfanyl]methylidene]azanium chloride Traditional Name: [amino-[[2-ethoxy-5-(2-keto-2-methoxy-ethyl)benzyl]thio]methylene]ammonium chloride Formula: C13H19ClN2O3S MolecularWeight: 318.81956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)OC)CSC(=[NH2+])N.[Cl-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)OC)CSC(=[NH2+])N.[Cl-]

InChI

InChI=1S/C13H18N2O3S.ClH/c1-3-18-11-5-4-9(7-12(16)17-2)6-10(11)8-19-13(14)15;/h4-6H,3,7-8H2,1-2H3,(H3,14,15);1H