2-(4-cyanophenoxy)ethyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: 2-(4-cyanophenoxy)ethyl (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-2-propenoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl (E)-3-(5-chloro-1,3-dimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)acrylic acid 2-(4-cyanophenoxy)ethyl ester Formula: C17H16ClN3O3 MolecularWeight: 345.78024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCCOC2=CC=C(C=C2)C#N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OCCOC2=CC=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C17H16ClN3O3/c1-12-15(17(18)21(2)20-12)7-8-16(22)24-10-9-23-14-5-3-13(11-19)4-6-14/h3-8H,9-10H2,1-2H3/b8-7+