ethyl 1-[1-(2,5-dimethylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(2,5-dimethylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-(2,5-dimethylphenyl)-2,5-dioxo-pyrrolidin-3-yl]piperidine-3-carboxylate CAS Name: 1-[1-(2,5-dimethylphenyl)-2,5-dioxo-3-pyrrolidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2,5-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-3-carboxylate Traditional Name: 1-[1-(2,5-dimethylphenyl)-2,5-diketo-pyrrolidin-3-yl]nipecotic acid ethyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2CC(=O)N(C2=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2CC(=O)N(C2=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H26N2O4/c1-4-26-20(25)15-6-5-9-21(12-15)17-11-18(23)22(19(17)24)16-10-13(2)7-8-14(16)3/h7-8,10,15,17H,4-6,9,11-12H2,1-3H3