ethyl 5-[4-[4-[2-(3-methoxyphenyl)ethanoyl]piperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[4-[4-[2-(3-methoxyphenyl)ethanoyl]piperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[4-[2-(3-methoxyphenyl)acetyl]piperazin-1-yl]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylate CAS Name: 5-[4-[4-[2-(3-methoxyphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-1-(2-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[4-[2-(3-methoxyphenyl)acetyl]piperazin-1-yl]phenyl]-1-pyridin-2-ylpyrazole-3-carboxylate Traditional Name: 5-[4-[4-[2-(3-methoxyphenyl)acetyl]piperazino]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C30H31N5O4 MolecularWeight: 525.59824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC(=CC=C4)OC)C5=CC=CC=N5

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)CC4=CC(=CC=C4)OC)C5=CC=CC=N5

InChI

InChI=1S/C30H31N5O4/c1-3-39-30(37)26-21-27(35(32-26)28-9-4-5-14-31-28)23-10-12-24(13-11-23)33-15-17-34(18-16-33)29(36)20-22-7-6-8-25(19-22)38-2/h4-14,19,21H,3,15-18,20H2,1-2H3