phenyl 4-[[3-[(E)-2-(3-nitrophenyl)ethenyl]quinoxalin-2-yl]oxymethyl]benzoate

Systemtic Name: phenyl 4-[[3-[(E)-2-(3-nitrophenyl)ethenyl]quinoxalin-2-yl]oxymethyl]benzoate Openeye Name: phenyl 4-[[3-[(E)-2-(3-nitrophenyl)vinyl]quinoxalin-2-yl]oxymethyl]benzoate CAS Name: 4-[[3-[(E)-2-(3-nitrophenyl)ethenyl]-2-quinoxalinyl]oxymethyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-[[3-[(E)-2-(3-nitrophenyl)ethenyl]quinoxalin-2-yl]oxymethyl]benzoate Traditional Name: 4-[[3-[(E)-2-(3-nitrophenyl)vinyl]quinoxalin-2-yl]oxymethyl]benzoic acid phenyl ester Formula: C30H21N3O5 MolecularWeight: 503.50484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)COC3=NC4=CC=CC=C4N=C3C=CC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)COC3=NC4=CC=CC=C4N=C3/C=C/C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H21N3O5/c34-30(38-25-9-2-1-3-10-25)23-16-13-22(14-17-23)20-37-29-28(31-26-11-4-5-12-27(26)32-29)18-15-21-7-6-8-24(19-21)33(35)36/h1-19H,20H2/b18-15+