3-[(4-nitrophenyl)methyl]-3-phenyl-1-benzofuran-2-one

Systemtic Name: 3-[(4-nitrophenyl)methyl]-3-phenyl-1-benzofuran-2-one Openeye Name: 3-[(4-nitrophenyl)methyl]-3-phenyl-benzofuran-2-one CAS Name: 3-[(4-nitrophenyl)methyl]-3-phenyl-2-benzofuranone IUPAC Name: 3-[(4-nitrophenyl)methyl]-3-phenyl-1-benzofuran-2-one Traditional Name: 3-(4-nitrobenzyl)-3-phenyl-coumaran-2-one Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=CC=CC=C3OC2=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=CC=CC=C3OC2=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO4/c23-20-21(16-6-2-1-3-7-16,18-8-4-5-9-19(18)26-20)14-15-10-12-17(13-11-15)22(24)25/h1-13H,14H2