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

Systemtic Name: methyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-7-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[[(2Z)-6-hydroxy-3-oxo-2-(3-pyridylmethylene)benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: [(2Z)-6-hydroxy-3-oxo-2-(3-pyridinylmethylidene)-7-benzofuranyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[(2Z)-6-hydroxy-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: benzyl-[[(2Z)-6-hydroxy-3-keto-2-(3-pyridylmethylene)coumaran-7-yl]methyl]-methyl-ammonium Formula: C23H21N2O3+ MolecularWeight: 373.42444

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CN=CC=C4)C3=O)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2O/C(=C\C4=CN=CC=C4)/C3=O)O

InChI

InChI=1S/C23H20N2O3/c1-25(14-16-6-3-2-4-7-16)15-19-20(26)10-9-18-22(27)21(28-23(18)19)12-17-8-5-11-24-13-17/h2-13,26H,14-15H2,1H3/p+1/b21-12-