2-[4-[4-(4-cyanophenyl)piperazin-1-yl]-1-(2-oxidanidyl-2-oxidanylidene-ethyl)piperidin-3-yl]ethanoate

Systemtic Name: 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]-1-(2-oxidanidyl-2-oxidanylidene-ethyl)piperidin-3-yl]ethanoate Openeye Name: 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]-1-(2-oxido-2-oxo-ethyl)-3-piperidyl]acetate CAS Name: 2-[4-[4-(4-cyanophenyl)-1-piperazinyl]-1-(2-oxido-2-oxoethyl)-3-piperidinyl]acetate IUPAC Name: 2-[4-[4-(4-cyanophenyl)piperazin-1-yl]-1-(2-oxido-2-oxoethyl)piperidin-3-yl]acetate Traditional Name: 2-[4-[4-(4-cyanophenyl)piperazino]-1-(2-keto-2-oxido-ethyl)-3-piperidyl]acetate Formula: C20H24N4O4-2 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1N2CCN(CC2)C3=CC=C(C=C3)C#N)CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

C1CN(CC(C1N2CCN(CC2)C3=CC=C(C=C3)C#N)CC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C20H26N4O4/c21-12-15-1-3-17(4-2-15)23-7-9-24(10-8-23)18-5-6-22(14-20(27)28)13-16(18)11-19(25)26/h1-4,16,18H,5-11,13-14H2,(H,25,26)(H,27,28)/p-2