ethyl 1-[3,4-bis(oxidanylidene)-2-(3-piperidin-1-ylpropylamino)cyclobuten-1-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3,4-bis(oxidanylidene)-2-(3-piperidin-1-ylpropylamino)cyclobuten-1-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3,4-dioxo-2-[3-(1-piperidyl)propylamino]cyclobuten-1-yl]piperidine-4-carboxylate CAS Name: 1-[3,4-dioxo-2-[3-(1-piperidinyl)propylamino]-1-cyclobutenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3,4-dioxo-2-(3-piperidin-1-ylpropylamino)cyclobuten-1-yl]piperidine-4-carboxylate Traditional Name: 1-[3,4-diketo-2-(3-piperidinopropylamino)cyclobuten-1-yl]isonipecotic acid ethyl ester Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=O)C2=O)NCCCN3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=O)C2=O)NCCCN3CCCCC3

InChI

InChI=1S/C20H31N3O4/c1-2-27-20(26)15-7-13-23(14-8-15)17-16(18(24)19(17)25)21-9-6-12-22-10-4-3-5-11-22/h15,21H,2-14H2,1H3