(E)-1-(3-methoxy-4-oxidanyl-phenyl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(3-methoxy-4-oxidanyl-phenyl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-1-(4-hydroxy-3-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-hydroxy-3-methoxyphenyl)-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)-1-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]-1-(4-hydroxy-3-methoxy-phenyl)prop-2-en-1-one Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)O

InChI

InChI=1S/C25H21N3O3/c1-31-24-14-19(9-12-23(24)30)22(29)11-10-21-17-28(16-18-6-3-2-4-7-18)27-25(21)20-8-5-13-26-15-20/h2-15,17,30H,16H2,1H3/b11-10+