[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)isoindole-5-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)isoindole-5-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 1,3-dioxo-2-(3-pyridylmethyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(3-pyridinylmethyl)-5-isoindolecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 1,3-dioxo-2-(pyridin-3-ylmethyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(3-pyridylmethyl)isoindoline-5-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C23H15N3O7 MolecularWeight: 445.3811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CN=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CN=CC=C4

InChI

InChI=1S/C23H15N3O7/c27-20(15-4-1-5-17(9-15)26(31)32)13-33-23(30)16-6-7-18-19(10-16)22(29)25(21(18)28)12-14-3-2-8-24-11-14/h1-11H,12-13H2