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

Systemtic Name: phenyl (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: phenyl (4E)-4-[(2,4-dinitrophenyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid phenyl ester IUPAC Name: phenyl (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(2,4-dinitrophenyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid phenyl ester Formula: C22H18N4O7 MolecularWeight: 450.40092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])CCC2)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/CCC2)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O7/c1-13-20-17(24-23-16-11-10-14(25(28)29)12-18(16)26(30)31)8-5-9-19(20)33-21(13)22(27)32-15-6-3-2-4-7-15/h2-4,6-7,10-12,23H,5,8-9H2,1H3/b24-17+