N-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-N-(4-ethoxyphenyl)-3-nitro-benzamide

Systemtic Name: N-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-N-(4-ethoxyphenyl)-3-nitro-benzamide Openeye Name: N-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-N-(4-ethoxyphenyl)-3-nitro-benzamide CAS Name: N-[2-(1,3-dioxo-2-isoindolyl)ethyl]-N-(4-ethoxyphenyl)-3-nitrobenzamide IUPAC Name: N-[2-(1,3-dioxoisoindol-2-yl)ethyl]-N-(4-ethoxyphenyl)-3-nitrobenzamide Traditional Name: 3-nitro-N-(2-phthalimidoethyl)-N-p-phenetyl-benzamide Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O6/c1-2-34-20-12-10-18(11-13-20)26(23(29)17-6-5-7-19(16-17)28(32)33)14-15-27-24(30)21-8-3-4-9-22(21)25(27)31/h3-13,16H,2,14-15H2,1H3