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

Systemtic Name: (4E)-4-[(4-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylic acid Openeye Name: (4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid CAS Name: (4E)-4-[[(4-bromophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid IUPAC Name: (4E)-4-[(4-bromobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylic acid Traditional Name: (4E)-4-[(4-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid Formula: C17H15BrN2O4 MolecularWeight: 391.216

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN2O4/c1-9-14-12(3-2-4-13(14)24-15(9)17(22)23)19-20-16(21)10-5-7-11(18)8-6-10/h5-8H,2-4H2,1H3,(H,20,21)(H,22,23)/b19-12+