N-(2,5-dimethylphenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-3-phenyl-propanamide CAS Name: N-(2,5-dimethylphenyl)-2-(4-nitro-1,3-dioxo-2-isoindolyl)-3-phenylpropanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)-3-phenylpropanamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(2,5-dimethylphenyl)-3-phenyl-propionamide Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O5/c1-15-11-12-16(2)19(13-15)26-23(29)21(14-17-7-4-3-5-8-17)27-24(30)18-9-6-10-20(28(32)33)22(18)25(27)31/h3-13,21H,14H2,1-2H3,(H,26,29)