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

Systemtic Name: methyl 4-[[(4E)-4-[(4-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[(4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[(4E)-4-[[(4-bromophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4E)-4-[(4-bromobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[(4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoic acid methyl ester Formula: C25H22BrN3O5 MolecularWeight: 524.36328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)Br)CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)Br)/CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H22BrN3O5/c1-14-21-19(28-29-23(30)15-6-10-17(26)11-7-15)4-3-5-20(21)34-22(14)24(31)27-18-12-8-16(9-13-18)25(32)33-2/h6-13H,3-5H2,1-2H3,(H,27,31)(H,29,30)/b28-19+