ethyl 4-[3,4-bis(oxidanylidene)-2-(4-pyridin-2-ylpiperazin-1-yl)cyclobuten-1-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3,4-bis(oxidanylidene)-2-(4-pyridin-2-ylpiperazin-1-yl)cyclobuten-1-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3,4-dioxo-2-[4-(2-pyridyl)piperazin-1-yl]cyclobuten-1-yl]piperazine-1-carboxylate CAS Name: 4-[3,4-dioxo-2-[4-(2-pyridinyl)-1-piperazinyl]-1-cyclobutenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3,4-dioxo-2-(4-pyridin-2-ylpiperazin-1-yl)cyclobuten-1-yl]piperazine-1-carboxylate Traditional Name: 4-[3,4-diketo-2-[4-(2-pyridyl)piperazino]cyclobuten-1-yl]piperazine-1-carboxylic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H25N5O4/c1-2-29-20(28)25-13-11-24(12-14-25)17-16(18(26)19(17)27)23-9-7-22(8-10-23)15-5-3-4-6-21-15/h3-6H,2,7-14H2,1H3