(2,6-dimethylphenyl) (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: (2,6-dimethylphenyl) (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: (2,6-dimethylphenyl) (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid (2,6-dimethylphenyl) ester Formula: C17H20N2O2 MolecularWeight: 284.3529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C=CC2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)/C=C/C2=C(N(N=C2C)C)C

InChI

InChI=1S/C17H20N2O2/c1-11-7-6-8-12(2)17(11)21-16(20)10-9-15-13(3)18-19(5)14(15)4/h6-10H,1-5H3/b10-9+