4-pyrrolidin-1-ylbut-2-ynyl 1-phenylcyclopentane-1-carboxylate

Systemtic Name: 4-pyrrolidin-1-ylbut-2-ynyl 1-phenylcyclopentane-1-carboxylate Openeye Name: 4-pyrrolidin-1-ylbut-2-ynyl 1-phenylcyclopentanecarboxylate CAS Name: 1-phenyl-1-cyclopentanecarboxylic acid 4-(1-pyrrolidinyl)but-2-ynyl ester IUPAC Name: 4-pyrrolidin-1-ylbut-2-ynyl 1-phenylcyclopentane-1-carboxylate Traditional Name: 1-phenylcyclopentanecarboxylic acid 4-pyrrolidinobut-2-ynyl ester Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CC=C2)C(=O)OCC#CCN3CCCC3

Isomeric SMILES

C1CCC(C1)(C2=CC=CC=C2)C(=O)OCC#CCN3CCCC3

InChI

InChI=1S/C20H25NO2/c22-19(23-17-9-8-16-21-14-6-7-15-21)20(12-4-5-13-20)18-10-2-1-3-11-18/h1-3,10-11H,4-7,12-17H2