potassium (4E)-3-methyl-4-(2-phenylethanoylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: potassium (4E)-3-methyl-4-(2-phenylethanoylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: potassium (4E)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: potassium (4E)-3-methyl-4-[(1-oxo-2-phenylethyl)hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylate IUPAC Name: potassium (4E)-3-methyl-4-[(2-phenylacetyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: potassium (4E)-3-methyl-4-[(2-phenylacetyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate Formula: C18H17KN2O4 MolecularWeight: 364.43688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)CC3=CC=CC=C3)CCC2)C(=O)[O-].[K+]

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)CC3=CC=CC=C3)/CCC2)C(=O)[O-].[K+]

InChI

InChI=1S/C18H18N2O4.K/c1-11-16-13(8-5-9-14(16)24-17(11)18(22)23)19-20-15(21)10-12-6-3-2-4-7-12;/h2-4,6-7H,5,8-10H2,1H3,(H,20,21)(H,22,23);/q;+1/p-1/b19-13+;