4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-nitrophenyl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-nitrophenyl)butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-(3-nitrophenyl)butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-(3-nitrophenyl)butanamide Traditional Name: N-(3-nitrophenyl)-4-phthalimido-butyramide Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O5/c22-16(19-12-5-3-6-13(11-12)21(25)26)9-4-10-20-17(23)14-7-1-2-8-15(14)18(20)24/h1-3,5-8,11H,4,9-10H2,(H,19,22)