methyl (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate Openeye Name: methyl (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[5-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-acrylic acid methyl ester Formula: C14H10BrN3O2 MolecularWeight: 332.1521

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(NN=C1)C2=CC=C(C=C2)Br)C#N

Isomeric SMILES

COC(=O)/C(=C\C1=C(NN=C1)C2=CC=C(C=C2)Br)/C#N

InChI

InChI=1S/C14H10BrN3O2/c1-20-14(19)10(7-16)6-11-8-17-18-13(11)9-2-4-12(15)5-3-9/h2-6,8H,1H3,(H,17,18)/b10-6-