3-[(E)-2-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[(E)-2-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]ethenyl]-1H-quinoxalin-2-one Openeye Name: 3-[(E)-2-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)vinyl]-1H-quinoxalin-2-one CAS Name: 3-[(E)-2-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]ethenyl]-1H-quinoxalin-2-one IUPAC Name: 3-[(E)-2-(1-benzyl-3,5-dimethylpyrazol-4-yl)ethenyl]-1H-quinoxalin-2-one Traditional Name: 3-[(E)-2-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)vinyl]-1H-quinoxalin-2-one Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=CC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=C/C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H20N4O/c1-15-18(16(2)26(25-15)14-17-8-4-3-5-9-17)12-13-21-22(27)24-20-11-7-6-10-19(20)23-21/h3-13H,14H2,1-2H3,(H,24,27)/b13-12+