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

Systemtic Name: naphthalen-1-yl (4E)-4-[(4-chloranyl-3-nitro-phenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 1-naphthyl (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[[(4-chloro-3-nitrophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 1-naphthalenyl ester IUPAC Name: naphthalen-1-yl (4E)-4-[(4-chloro-3-nitrobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(4-chloro-3-nitro-benzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid 1-naphthyl ester Formula: C27H20ClN3O6 MolecularWeight: 517.9172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])CCC2)C(=O)OC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])/CCC2)C(=O)OC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H20ClN3O6/c1-15-24-20(29-30-26(32)17-12-13-19(28)21(14-17)31(34)35)9-5-11-23(24)36-25(15)27(33)37-22-10-4-7-16-6-2-3-8-18(16)22/h2-4,6-8,10,12-14H,5,9,11H2,1H3,(H,30,32)/b29-20+