ethyl 4-(2-pyrrolidin-2-ylethynyl)benzoate

Systemtic Name: ethyl 4-(2-pyrrolidin-2-ylethynyl)benzoate Openeye Name: ethyl 4-(2-pyrrolidin-2-ylethynyl)benzoate CAS Name: 4-[2-(2-pyrrolidinyl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-pyrrolidin-2-ylethynyl)benzoate Traditional Name: 4-(2-pyrrolidin-2-ylethynyl)benzoic acid ethyl ester Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CC2CCCN2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CC2CCCN2

InChI

InChI=1S/C15H17NO2/c1-2-18-15(17)13-8-5-12(6-9-13)7-10-14-4-3-11-16-14/h5-6,8-9,14,16H,2-4,11H2,1H3