ethyl 5-[4-[4-(4-methoxycarbonylphenyl)carbonylpiperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[4-[4-(4-methoxycarbonylphenyl)carbonylpiperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[4-(4-methoxycarbonylbenzoyl)piperazin-1-yl]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylate CAS Name: 5-[4-[4-[(4-methoxycarbonylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-1-(2-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[4-(4-methoxycarbonylbenzoyl)piperazin-1-yl]phenyl]-1-pyridin-2-ylpyrazole-3-carboxylate Traditional Name: 5-[4-[4-(4-carbomethoxybenzoyl)piperazino]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C30H29N5O5 MolecularWeight: 539.58176

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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)C4=CC=C(C=C4)C(=O)OC)C5=CC=CC=N5

Isomeric SMILES

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

InChI

InChI=1S/C30H29N5O5/c1-3-40-30(38)25-20-26(35(32-25)27-6-4-5-15-31-27)21-11-13-24(14-12-21)33-16-18-34(19-17-33)28(36)22-7-9-23(10-8-22)29(37)39-2/h4-15,20H,3,16-19H2,1-2H3