3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(oxolan-2-ylmethyl)propanamide

Systemtic Name: 3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(oxolan-2-ylmethyl)propanamide Openeye Name: 3-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-(tetrahydrofuran-2-ylmethyl)propanamide CAS Name: 3-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(2-oxolanylmethyl)propanamide IUPAC Name: 3-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(oxolan-2-ylmethyl)propanamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(tetrahydrofurfuryl)propionamide Formula: C16H17N3O6 MolecularWeight: 347.32268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6/c20-13(17-9-10-3-2-8-25-10)6-7-18-15(21)11-4-1-5-12(19(23)24)14(11)16(18)22/h1,4-5,10H,2-3,6-9H2,(H,17,20)