(4-nitrophenyl)methyl 5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 5-chloro-2,3-dihydrobenzofuran-2-carboxylate CAS Name: 5-chloro-2,3-dihydrobenzofuran-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-chloro-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: 5-chlorocoumaran-2-carboxylic acid (4-nitrobenzyl) ester Formula: C16H12ClNO5 MolecularWeight: 333.72318

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClNO5/c17-12-3-6-14-11(7-12)8-15(23-14)16(19)22-9-10-1-4-13(5-2-10)18(20)21/h1-7,15H,8-9H2