1-[3-(3-cyclopentyloxy-4-methoxy-phenyl)pyrrolidin-1-yl]but-2-yn-1-one

Systemtic Name: 1-[3-(3-cyclopentyloxy-4-methoxy-phenyl)pyrrolidin-1-yl]but-2-yn-1-one Openeye Name: 1-[3-[3-(cyclopentoxy)-4-methoxy-phenyl]pyrrolidin-1-yl]but-2-yn-1-one CAS Name: 1-[3-(3-cyclopentyloxy-4-methoxyphenyl)-1-pyrrolidinyl]-2-butyn-1-one IUPAC Name: 1-[3-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-1-yl]but-2-yn-1-one Traditional Name: 1-[3-[3-(cyclopentoxy)-4-methoxy-phenyl]pyrrolidino]but-2-yn-1-one Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCC(C1)C2=CC(=C(C=C2)OC)OC3CCCC3

Isomeric SMILES

CC#CC(=O)N1CCC(C1)C2=CC(=C(C=C2)OC)OC3CCCC3

InChI

InChI=1S/C20H25NO3/c1-3-6-20(22)21-12-11-16(14-21)15-9-10-18(23-2)19(13-15)24-17-7-4-5-8-17/h9-10,13,16-17H,4-5,7-8,11-12,14H2,1-2H3