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

Systemtic Name: N-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-N-(4-tert-butylphenyl)-2-nitro-benzamide Openeye Name: N-(4-tert-butylphenyl)-N-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-2-nitro-benzamide CAS Name: N-(4-tert-butylphenyl)-N-[2-(1,3-dioxo-2-isoindolyl)ethyl]-2-nitrobenzamide IUPAC Name: N-(4-tert-butylphenyl)-N-[2-(1,3-dioxoisoindol-2-yl)ethyl]-2-nitrobenzamide Traditional Name: N-(4-tert-butylphenyl)-2-nitro-N-(2-phthalimidoethyl)benzamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O5/c1-27(2,3)18-12-14-19(15-13-18)28(26(33)22-10-6-7-11-23(22)30(34)35)16-17-29-24(31)20-8-4-5-9-21(20)25(29)32/h4-15H,16-17H2,1-3H3