naphthalen-2-yl (4E)-4-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: naphthalen-2-yl (4E)-4-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 2-naphthyl (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[[(5-bromo-3-pyridinyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl (4E)-4-[(5-bromopyridine-3-carbonyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(5-bromonicotinoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 2-naphthyl ester Formula: C26H20BrN3O4 MolecularWeight: 518.3587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CN=C3)Br)CCC2)C(=O)OC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CN=C3)Br)/CCC2)C(=O)OC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H20BrN3O4/c1-15-23-21(29-30-25(31)18-11-19(27)14-28-13-18)7-4-8-22(23)34-24(15)26(32)33-20-10-9-16-5-2-3-6-17(16)12-20/h2-3,5-6,9-14H,4,7-8H2,1H3,(H,30,31)/b29-21+