dimethyl 2,6-bis[1,3-bis(oxidanylidene)isoindol-2-yl]-4-nitro-heptanedioate

Systemtic Name: dimethyl 2,6-bis[1,3-bis(oxidanylidene)isoindol-2-yl]-4-nitro-heptanedioate Openeye Name: dimethyl 2,6-bis(1,3-dioxoisoindolin-2-yl)-4-nitro-heptanedioate CAS Name: 2,6-bis(1,3-dioxo-2-isoindolyl)-4-nitroheptanedioic acid dimethyl ester IUPAC Name: dimethyl 2,6-bis(1,3-dioxoisoindol-2-yl)-4-nitroheptanedioate Traditional Name: 4-nitro-2,6-diphthalimido-pimelic acid dimethyl ester Formula: C25H21N3O10 MolecularWeight: 523.44834

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(CC(C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C(CC(CC(C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O10/c1-37-24(33)18(26-20(29)14-7-3-4-8-15(14)21(26)30)11-13(28(35)36)12-19(25(34)38-2)27-22(31)16-9-5-6-10-17(16)23(27)32/h3-10,13,18-19H,11-12H2,1-2H3