methyl (E)-3-[5-chloranyl-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[5-chloranyl-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate Openeye Name: methyl (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methyl-4-pyrazolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[5-chloro-1-[(3-methoxyphenyl)methyl]-3-methylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-(5-chloro-1-m-anisyl-3-methyl-pyrazol-4-yl)acrylic acid methyl ester Formula: C16H17ClN2O3 MolecularWeight: 320.77078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OC)Cl)CC2=CC(=CC=C2)OC

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OC)Cl)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C16H17ClN2O3/c1-11-14(7-8-15(20)22-3)16(17)19(18-11)10-12-5-4-6-13(9-12)21-2/h4-9H,10H2,1-3H3/b8-7+