N-[1,3-bis(oxidanyl)-1-[6-(7-phenylhept-1-ynyl)pyridin-2-yl]propyl]ethanamide

Systemtic Name: N-[1,3-bis(oxidanyl)-1-[6-(7-phenylhept-1-ynyl)pyridin-2-yl]propyl]ethanamide Openeye Name: N-[1,3-dihydroxy-1-[6-(7-phenylhept-1-ynyl)-2-pyridyl]propyl]acetamide CAS Name: N-[1,3-dihydroxy-1-[6-(7-phenylhept-1-ynyl)-2-pyridinyl]propyl]acetamide IUPAC Name: N-[1,3-dihydroxy-1-[6-(7-phenylhept-1-ynyl)pyridin-2-yl]propyl]acetamide Traditional Name: N-[1,3-dihydroxy-1-[6-(7-phenylhept-1-ynyl)-2-pyridyl]propyl]acetamide Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCO)(C1=CC=CC(=N1)C#CCCCCCC2=CC=CC=C2)O

Isomeric SMILES

CC(=O)NC(CCO)(C1=CC=CC(=N1)C#CCCCCCC2=CC=CC=C2)O

InChI

InChI=1S/C23H28N2O3/c1-19(27)25-23(28,17-18-26)22-16-10-15-21(24-22)14-9-4-2-3-6-11-20-12-7-5-8-13-20/h5,7-8,10,12-13,15-16,26,28H,2-4,6,11,17-18H2,1H3,(H,25,27)