pentane; 1-(4-phenoxyphenyl)-2-pyridin-3-yl-ethanone

Systemtic Name: pentane; 1-(4-phenoxyphenyl)-2-pyridin-3-yl-ethanone Openeye Name: pentane; 1-(4-phenoxyphenyl)-2-(3-pyridyl)ethanone CAS Name: pentane; 1-(4-phenoxyphenyl)-2-(3-pyridinyl)ethanone IUPAC Name: pentane; 1-(4-phenoxyphenyl)-2-pyridin-3-ylethanone Traditional Name: n-pentane; 1-(4-phenoxyphenyl)-2-(3-pyridyl)ethanone Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC.C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CC3=CN=CC=C3

Isomeric SMILES

CCCCC.C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CC3=CN=CC=C3

InChI

InChI=1S/C19H15NO2.C5H12/c21-19(13-15-5-4-12-20-14-15)16-8-10-18(11-9-16)22-17-6-2-1-3-7-17;1-3-5-4-2/h1-12,14H,13H2;3-5H2,1-2H3