1-[4-[4-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[2,4-dinitro-5-(1-piperidylamino)phenoxy]phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[2,4-dinitro-5-(1-piperidinylamino)phenoxy]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]phenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[2,4-dinitro-5-(piperidinoamino)phenoxy]phenyl]piperazino]ethanone Formula: C23H28N6O6 MolecularWeight: 484.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C(C=C(C(=C3)NN4CCCCC4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC3=C(C=C(C(=C3)NN4CCCCC4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H28N6O6/c1-17(30)25-11-13-26(14-12-25)18-5-7-19(8-6-18)35-23-15-20(24-27-9-3-2-4-10-27)21(28(31)32)16-22(23)29(33)34/h5-8,15-16,24H,2-4,9-14H2,1H3