[(2E)-2-(1-benzofuran-2-ylmethylidene)-4-methyl-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-bis(2-methoxyethyl)azanium

Systemtic Name: [(2E)-2-(1-benzofuran-2-ylmethylidene)-4-methyl-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-bis(2-methoxyethyl)azanium Openeye Name: [(2E)-2-(benzofuran-2-ylmethylene)-6-hydroxy-4-methyl-3-oxo-benzofuran-7-yl]methyl-bis(2-methoxyethyl)ammonium CAS Name: [(2E)-2-(2-benzofuranylmethylidene)-6-hydroxy-4-methyl-3-oxo-7-benzofuranyl]methyl-bis(2-methoxyethyl)ammonium IUPAC Name: [(2E)-2-(1-benzofuran-2-ylmethylidene)-6-hydroxy-4-methyl-3-oxo-1-benzofuran-7-yl]methyl-bis(2-methoxyethyl)azanium Traditional Name: [(2E)-2-(benzofuran-2-ylmethylene)-6-hydroxy-3-keto-4-methyl-coumaran-7-yl]methyl-bis(2-methoxyethyl)ammonium Formula: C25H28NO6+ MolecularWeight: 438.49292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC4=CC=CC=C4O3)O2)C[NH+](CCOC)CCOC)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C\C3=CC4=CC=CC=C4O3)/O2)C[NH+](CCOC)CCOC)O

InChI

InChI=1S/C25H27NO6/c1-16-12-20(27)19(15-26(8-10-29-2)9-11-30-3)25-23(16)24(28)22(32-25)14-18-13-17-6-4-5-7-21(17)31-18/h4-7,12-14,27H,8-11,15H2,1-3H3/p+1/b22-14+