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

Systemtic Name: ethyl 4-[2-(3,4-dimethylphenyl)-3,4-bis(oxidanylidene)cyclobuten-1-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3,4-dimethylphenyl)-3,4-dioxo-cyclobuten-1-yl]piperazine-1-carboxylate CAS Name: 4-[2-(3,4-dimethylphenyl)-3,4-dioxo-1-cyclobutenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,4-dimethylphenyl)-3,4-dioxocyclobuten-1-yl]piperazine-1-carboxylate Traditional Name: 4-[2-(3,4-dimethylphenyl)-3,4-diketo-cyclobuten-1-yl]piperazine-1-carboxylic acid ethyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C19H22N2O4/c1-4-25-19(24)21-9-7-20(8-10-21)16-15(17(22)18(16)23)14-6-5-12(2)13(3)11-14/h5-6,11H,4,7-10H2,1-3H3