[4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethyl-pyrazol-3-yl] (Z)-2-methoxybut-2-enoate

Systemtic Name: [4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethyl-pyrazol-3-yl] (Z)-2-methoxybut-2-enoate Openeye Name: [4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethyl-pyrazol-3-yl] (Z)-2-methoxybut-2-enoate CAS Name: (Z)-2-methoxy-2-butenoic acid [4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethyl-3-pyrazolyl] ester IUPAC Name: [4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethylpyrazol-3-yl] (Z)-2-methoxybut-2-enoate Traditional Name: (Z)-2-methoxybut-2-enoic acid [4-[2-(4-chlorophenyl)ethynyl]-2,5-dimethyl-pyrazol-3-yl] ester Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(=O)OC1=C(C(=NN1C)C)C#CC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

C/C=C(/C(=O)OC1=C(C(=NN1C)C)C#CC2=CC=C(C=C2)Cl)\OC

InChI

InChI=1S/C18H17ClN2O3/c1-5-16(23-4)18(22)24-17-15(12(2)20-21(17)3)11-8-13-6-9-14(19)10-7-13/h5-7,9-10H,1-4H3/b16-5-