tert-butyl 2-[2-(4-ethoxycarbonylphenyl)ethynyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[2-(4-ethoxycarbonylphenyl)ethynyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[2-(4-ethoxycarbonylphenyl)ethynyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-(4-ethoxycarbonylphenyl)ethynyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(4-ethoxycarbonylphenyl)ethynyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-(4-carbethoxyphenyl)ethynyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C20H25NO4/c1-5-24-18(22)16-11-8-15(9-12-16)10-13-17-7-6-14-21(17)19(23)25-20(2,3)4/h8-9,11-12,17H,5-7,14H2,1-4H3