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

Systemtic Name: methyl 4-[[(4E)-4-[(2-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[(4E)-4-[(2-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[(4E)-4-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4E)-4-[(2-bromobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[(4E)-4-[(2-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=CC=C3Br)CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CC=C3Br)/CCC2)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H22BrN3O5/c1-14-21-19(28-29-23(30)17-6-3-4-7-18(17)26)8-5-9-20(21)34-22(14)24(31)27-16-12-10-15(11-13-16)25(32)33-2/h3-4,6-7,10-13H,5,8-9H2,1-2H3,(H,27,31)(H,29,30)/b28-19+