[3-(4-nitrophenyl)carbonyl-2-(phenylmethyl)-1-benzofuran-5-yl] benzoate

Systemtic Name: [3-(4-nitrophenyl)carbonyl-2-(phenylmethyl)-1-benzofuran-5-yl] benzoate Openeye Name: [2-benzyl-3-(4-nitrobenzoyl)benzofuran-5-yl] benzoate CAS Name: benzoic acid [3-[(4-nitrophenyl)-oxomethyl]-2-(phenylmethyl)-5-benzofuranyl] ester IUPAC Name: [2-benzyl-3-(4-nitrobenzoyl)-1-benzofuran-5-yl] benzoate Traditional Name: benzoic acid [2-benzyl-3-(4-nitrobenzoyl)benzofuran-5-yl] ester Formula: C29H19NO6 MolecularWeight: 477.46426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=C(O2)C=CC(=C3)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=C(O2)C=CC(=C3)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H19NO6/c31-28(20-11-13-22(14-12-20)30(33)34)27-24-18-23(35-29(32)21-9-5-2-6-10-21)15-16-25(24)36-26(27)17-19-7-3-1-4-8-19/h1-16,18H,17H2