pentyl 4-[5-(4-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: pentyl 4-[5-(4-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: pentyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-isoindolin-2-yl]benzoate CAS Name: 4-[5-(4-nitrophenoxy)-1,3-dioxo-2-isoindolyl]benzoic acid pentyl ester IUPAC Name: pentyl 4-[5-(4-nitrophenoxy)-1,3-dioxoisoindol-2-yl]benzoate Traditional Name: 4-[1,3-diketo-5-(4-nitrophenoxy)isoindolin-2-yl]benzoic acid amyl ester Formula: C26H22N2O7 MolecularWeight: 474.46208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H22N2O7/c1-2-3-4-15-34-26(31)17-5-7-18(8-6-17)27-24(29)22-14-13-21(16-23(22)25(27)30)35-20-11-9-19(10-12-20)28(32)33/h5-14,16H,2-4,15H2,1H3