diethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: diethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-7-yl]methyl]azanium Openeye Name: diethyl-[[(2Z)-6-hydroxy-2-[(4-isopropylphenyl)methylene]-3-oxo-benzofuran-7-yl]methyl]ammonium CAS Name: diethyl-[[(2Z)-6-hydroxy-3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-7-benzofuranyl]methyl]ammonium IUPAC Name: diethyl-[[(2Z)-6-hydroxy-3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-7-yl]methyl]azanium Traditional Name: diethyl-[[(2Z)-6-hydroxy-2-(4-isopropylbenzylidene)-3-keto-coumaran-7-yl]methyl]ammonium Formula: C23H28NO3+ MolecularWeight: 366.47332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)C(C)C)C2=O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO3/c1-5-24(6-2)14-19-20(25)12-11-18-22(26)21(27-23(18)19)13-16-7-9-17(10-8-16)15(3)4/h7-13,15,25H,5-6,14H2,1-4H3/p+1/b21-13-