methyl 2-[[(4E)-3-methyl-4-[(4-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(4E)-3-methyl-4-[(4-nitrophenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 2-[[[(4E)-3-methyl-4-[[(4-nitrophenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 2-[[(4E)-3-methyl-4-[(4-nitrobenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoic acid methyl ester Formula: C25H22N4O7 MolecularWeight: 490.46478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CCC2)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])/CCC2)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C25H22N4O7/c1-14-21-19(27-28-23(30)15-10-12-16(13-11-15)29(33)34)8-5-9-20(21)36-22(14)24(31)26-18-7-4-3-6-17(18)25(32)35-2/h3-4,6-7,10-13H,5,8-9H2,1-2H3,(H,26,31)(H,28,30)/b27-19+