dimethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-(thiophen-2-ylmethylidene)-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: dimethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-(thiophen-2-ylmethylidene)-1-benzofuran-7-yl]methyl]azanium Openeye Name: [(2Z)-6-hydroxy-3-oxo-2-(2-thienylmethylene)benzofuran-7-yl]methyl-dimethyl-ammonium CAS Name: [(2Z)-6-hydroxy-3-oxo-2-(thiophen-2-ylmethylidene)-7-benzofuranyl]methyl-dimethylammonium IUPAC Name: [(2Z)-6-hydroxy-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-7-yl]methyl-dimethylazanium Traditional Name: [(2Z)-6-hydroxy-3-keto-2-(2-thenylidene)coumaran-7-yl]methyl-dimethyl-ammonium Formula: C16H16NO3S+ MolecularWeight: 302.36814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO3S/c1-17(2)9-12-13(18)6-5-11-15(19)14(20-16(11)12)8-10-4-3-7-21-10/h3-8,18H,9H2,1-2H3/p+1/b14-8-