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

Systemtic Name: diethyl-[[6-oxidanyl-3-oxidanylidene-2-(thiophen-2-ylmethylidene)-1-benzofuran-7-yl]methyl]azanium Openeye Name: diethyl-[[6-hydroxy-3-oxo-2-(2-thienylmethylene)benzofuran-7-yl]methyl]ammonium CAS Name: diethyl-[[6-hydroxy-3-oxo-2-(thiophen-2-ylmethylidene)-7-benzofuranyl]methyl]ammonium IUPAC Name: diethyl-[[6-hydroxy-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-7-yl]methyl]azanium Traditional Name: diethyl-[[6-hydroxy-3-keto-2-(2-thenylidene)coumaran-7-yl]methyl]ammonium Formula: C18H20NO3S+ MolecularWeight: 330.4213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3S/c1-3-19(4-2)11-14-15(20)8-7-13-17(21)16(22-18(13)14)10-12-6-5-9-23-12/h5-10,20H,3-4,11H2,1-2H3/p+1