(4-nitrophenyl)methyl 1-chloranyl-3-oxidanylidene-2-benzofuran-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 1-chloranyl-3-oxidanylidene-2-benzofuran-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 1-chloro-3-oxo-isobenzofuran-1-carboxylate CAS Name: 1-chloro-3-oxo-1-isobenzofurancarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 1-chloro-3-oxo-2-benzofuran-1-carboxylate Traditional Name: 1-chloro-3-keto-phthalan-1-carboxylic acid (4-nitrobenzyl) ester Formula: C16H10ClNO6 MolecularWeight: 347.7067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2(C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H10ClNO6/c17-16(13-4-2-1-3-12(13)14(19)24-16)15(20)23-9-10-5-7-11(8-6-10)18(21)22/h1-8H,9H2