1-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]isonipecotamide Formula: C23H22N4O6 MolecularWeight: 450.44398

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O6/c28-19(14-26-22(30)17-7-4-8-18(27(32)33)20(17)23(26)31)25-11-9-16(10-12-25)21(29)24-13-15-5-2-1-3-6-15/h1-8,16H,9-14H2,(H,24,29)