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

Systemtic Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)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 [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)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 [4-(4-cyanophenyl)phenyl] ester Formula: C29H21N5O7 MolecularWeight: 551.50634

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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=C(C=C4)C5=CC=C(C=C5)C#N

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=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H21N5O7/c1-17-27-24(32-31-23-14-11-21(33(36)37)15-25(23)34(38)39)3-2-4-26(27)41-28(17)29(35)40-22-12-9-20(10-13-22)19-7-5-18(16-30)6-8-19/h5-15,31H,2-4H2,1H3/b32-24+