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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-nitrophenyl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(1,3-dioxoisoindolin-2-yl)-N-(3-nitrophenyl)butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-(3-nitrophenyl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(1,3-dioxoisoindol-2-yl)-N-(3-nitrophenyl)butanamide Traditional Name: N-benzyl-N-(3-nitrophenyl)-4-phthalimido-butyramide Formula: C25H21N3O5 MolecularWeight: 443.45134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC(=CC=C2)[N+](=O)[O-])C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O5/c29-23(14-7-15-26-24(30)21-12-4-5-13-22(21)25(26)31)27(17-18-8-2-1-3-9-18)19-10-6-11-20(16-19)28(32)33/h1-6,8-13,16H,7,14-15,17H2