1-(5-hexyl-4-methoxy-2-oxidanyl-phenyl)-2-(1-phenylpyrazol-4-yl)ethanone

Systemtic Name: 1-(5-hexyl-4-methoxy-2-oxidanyl-phenyl)-2-(1-phenylpyrazol-4-yl)ethanone Openeye Name: 1-(5-hexyl-2-hydroxy-4-methoxy-phenyl)-2-(1-phenylpyrazol-4-yl)ethanone CAS Name: 1-(5-hexyl-2-hydroxy-4-methoxyphenyl)-2-(1-phenyl-4-pyrazolyl)ethanone IUPAC Name: 1-(5-hexyl-2-hydroxy-4-methoxyphenyl)-2-(1-phenylpyrazol-4-yl)ethanone Traditional Name: 1-(5-hexyl-2-hydroxy-4-methoxy-phenyl)-2-(1-phenylpyrazol-4-yl)ethanone Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C(=C1)C(=O)CC2=CN(N=C2)C3=CC=CC=C3)O)OC

Isomeric SMILES

CCCCCCC1=C(C=C(C(=C1)C(=O)CC2=CN(N=C2)C3=CC=CC=C3)O)OC

InChI

InChI=1S/C24H28N2O3/c1-3-4-5-7-10-19-14-21(23(28)15-24(19)29-2)22(27)13-18-16-25-26(17-18)20-11-8-6-9-12-20/h6,8-9,11-12,14-17,28H,3-5,7,10,13H2,1-2H3