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

Systemtic Name: 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-4-nitro-benzamide Openeye Name: 3-[(1,3-dioxoisoindolin-2-yl)methyl]-4-nitro-benzamide CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]-4-nitrobenzamide IUPAC Name: 3-[(1,3-dioxoisoindol-2-yl)methyl]-4-nitrobenzamide Traditional Name: 4-nitro-3-(phthalimidomethyl)benzamide Formula: C16H11N3O5 MolecularWeight: 325.27564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C(C=CC(=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C(C=CC(=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O5/c17-14(20)9-5-6-13(19(23)24)10(7-9)8-18-15(21)11-3-1-2-4-12(11)16(18)22/h1-7H,8H2,(H2,17,20)