1-[3-(4-phenylphenyl)carbonylpiperidin-1-yl]but-2-yn-1-one

Systemtic Name: 1-[3-(4-phenylphenyl)carbonylpiperidin-1-yl]but-2-yn-1-one Openeye Name: 1-[3-(4-phenylbenzoyl)-1-piperidyl]but-2-yn-1-one CAS Name: 1-[3-[oxo-(4-phenylphenyl)methyl]-1-piperidinyl]-2-butyn-1-one IUPAC Name: 1-[3-(4-phenylbenzoyl)piperidin-1-yl]but-2-yn-1-one Traditional Name: 1-[3-(4-phenylbenzoyl)piperidino]but-2-yn-1-one Formula: C22H21NO2 MolecularWeight: 331.40764

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC#CC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO2/c1-2-7-21(24)23-15-6-10-20(16-23)22(25)19-13-11-18(12-14-19)17-8-4-3-5-9-17/h3-5,8-9,11-14,20H,6,10,15-16H2,1H3