(E)-3-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-(1-pyrazolylmethyl)phenyl]-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]-1-(p-tolyl)prop-2-en-1-one Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OC)CN3C=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OC)CN3C=CC=N3

InChI

InChI=1S/C21H20N2O2/c1-16-4-8-18(9-5-16)20(24)10-6-17-7-11-21(25-2)19(14-17)15-23-13-3-12-22-23/h3-14H,15H2,1-2H3/b10-6+