dibutyl-[[(2Z)-2-[(5-methylfuran-2-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: dibutyl-[[(2Z)-2-[(5-methylfuran-2-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium Openeye Name: dibutyl-[[(2Z)-6-hydroxy-2-[(5-methyl-2-furyl)methylene]-3-oxo-benzofuran-7-yl]methyl]ammonium CAS Name: dibutyl-[[(2Z)-6-hydroxy-2-[(5-methyl-2-furanyl)methylidene]-3-oxo-7-benzofuranyl]methyl]ammonium IUPAC Name: dibutyl-[[(2Z)-6-hydroxy-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-7-yl]methyl]azanium Traditional Name: dibutyl-[[(2Z)-6-hydroxy-3-keto-2-[(5-methyl-2-furyl)methylene]coumaran-7-yl]methyl]ammonium Formula: C23H30NO4+ MolecularWeight: 384.4886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC(=CC3=CC=C(O3)C)C2=O)O

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(C=CC2=C1O/C(=C\C3=CC=C(O3)C)/C2=O)O

InChI

InChI=1S/C23H29NO4/c1-4-6-12-24(13-7-5-2)15-19-20(25)11-10-18-22(26)21(28-23(18)19)14-17-9-8-16(3)27-17/h8-11,14,25H,4-7,12-13,15H2,1-3H3/p+1/b21-14-