potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylate IUPAC Name: potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: potassium (4E)-3-methyl-4-[(4-nitrophenyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate Formula: C16H14KN3O5 MolecularWeight: 367.39776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=CC=C(C=C3)[N+](=O)[O-])CCC2)C(=O)[O-].[K+]

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=CC=C(C=C3)[N+](=O)[O-])/CCC2)C(=O)[O-].[K+]

InChI

InChI=1S/C16H15N3O5.K/c1-9-14-12(3-2-4-13(14)24-15(9)16(20)21)18-17-10-5-7-11(8-6-10)19(22)23;/h5-8,17H,2-4H2,1H3,(H,20,21);/q;+1/p-1/b18-12+;