2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]ethanamide

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]ethanamide Openeye Name: 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]acetamide CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]acetamide IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]acetamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-[2-(4-phenylpiperazino)ethyl]acetamide Formula: C22H23N5O5 MolecularWeight: 437.44852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O5/c28-19(15-26-21(29)17-7-4-8-18(27(31)32)20(17)22(26)30)23-9-10-24-11-13-25(14-12-24)16-5-2-1-3-6-16/h1-8H,9-15H2,(H,23,28)