(6-ethyl-4-oxidanylidene-2-phenyl-chromen-3-yl) 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: (6-ethyl-4-oxidanylidene-2-phenyl-chromen-3-yl) 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: (6-ethyl-4-oxo-2-phenyl-chromen-3-yl) 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetate CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)acetic acid (6-ethyl-4-oxo-2-phenyl-1-benzopyran-3-yl) ester IUPAC Name: (6-ethyl-4-oxo-2-phenylchromen-3-yl) 2-(4-nitro-1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetic acid (6-ethyl-4-keto-2-phenyl-chromen-3-yl) ester Formula: C27H18N2O8 MolecularWeight: 498.44042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H18N2O8/c1-2-15-11-12-20-18(13-15)23(31)25(24(36-20)16-7-4-3-5-8-16)37-21(30)14-28-26(32)17-9-6-10-19(29(34)35)22(17)27(28)33/h3-13H,2,14H2,1H3