butyl-methyl-[[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: butyl-methyl-[[(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium Openeye Name: butyl-[[(2Z)-6-hydroxy-2-[(3-methyl-2-thienyl)methylene]-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: butyl-[[(2Z)-6-hydroxy-2-[(3-methyl-2-thiophenyl)methylidene]-3-oxo-7-benzofuranyl]methyl]-methylammonium IUPAC Name: butyl-[[(2Z)-6-hydroxy-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: butyl-[[(2Z)-6-hydroxy-3-keto-2-[(3-methyl-2-thienyl)methylene]coumaran-7-yl]methyl]-methyl-ammonium Formula: C20H24NO3S+ MolecularWeight: 358.47446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC2=C1OC(=CC3=C(C=CS3)C)C2=O)O

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC2=C1O/C(=C\C3=C(C=CS3)C)/C2=O)O

InChI

InChI=1S/C20H23NO3S/c1-4-5-9-21(3)12-15-16(22)7-6-14-19(23)17(24-20(14)15)11-18-13(2)8-10-25-18/h6-8,10-11,22H,4-5,9,12H2,1-3H3/p+1/b17-11-