4-[4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-[4-(1,3-dioxoisoindolin-2-yl)phenyl]sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-[4-(1,3-dioxo-2-isoindolyl)phenyl]sulfonyl-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-[4-(1,3-dioxoisoindol-2-yl)phenyl]sulfonylpiperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-[4-(4-phthalimidophenyl)sulfonylpiperazino]benzaldehyde Formula: C25H20N4O7S MolecularWeight: 520.5139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H20N4O7S/c30-16-17-5-10-22(23(15-17)29(33)34)26-11-13-27(14-12-26)37(35,36)19-8-6-18(7-9-19)28-24(31)20-3-1-2-4-21(20)25(28)32/h1-10,15-16H,11-14H2