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

Systemtic Name: ethyl 5-[4-[4-(2,4-dimethoxyphenyl)carbonylpiperazin-1-yl]phenyl]-1-pyridin-2-yl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[4-(2,4-dimethoxybenzoyl)piperazin-1-yl]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylate CAS Name: 5-[4-[4-[(2,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-1-(2-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[4-(2,4-dimethoxybenzoyl)piperazin-1-yl]phenyl]-1-pyridin-2-ylpyrazole-3-carboxylate Traditional Name: 5-[4-[4-(2,4-dimethoxybenzoyl)piperazino]phenyl]-1-(2-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C30H31N5O5 MolecularWeight: 541.59764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H31N5O5/c1-4-40-30(37)25-20-26(35(32-25)28-7-5-6-14-31-28)21-8-10-22(11-9-21)33-15-17-34(18-16-33)29(36)24-13-12-23(38-2)19-27(24)39-3/h5-14,19-20H,4,15-18H2,1-3H3