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

Systemtic Name: ethyl 1-[2-(4-chlorophenyl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-chlorophenyl)-3,4-dioxo-cyclobuten-1-yl]piperidine-4-carboxylate CAS Name: 1-[2-(4-chlorophenyl)-3,4-dioxo-1-cyclobutenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chlorophenyl)-3,4-dioxocyclobuten-1-yl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-chlorophenyl)-3,4-diketo-cyclobuten-1-yl]isonipecotic acid ethyl ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=O)C2=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=O)C2=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNO4/c1-2-24-18(23)12-7-9-20(10-8-12)15-14(16(21)17(15)22)11-3-5-13(19)6-4-11/h3-6,12H,2,7-10H2,1H3