(5-bromanyl-2-methoxy-phenyl)methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl (E)-3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl (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 (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl (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 (5-bromo-2-methoxy-benzyl) ester Formula: C16H16BrClN2O3 MolecularWeight: 399.66684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC2=C(C=CC(=C2)Br)OC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OCC2=C(C=CC(=C2)Br)OC)Cl)C

InChI

InChI=1S/C16H16BrClN2O3/c1-10-13(16(18)20(2)19-10)5-7-15(21)23-9-11-8-12(17)4-6-14(11)22-3/h4-8H,9H2,1-3H3/b7-5+