ethyl 1-(4-methoxyphenyl)-5-[4-(4-propanoylpiperazin-1-yl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-methoxyphenyl)-5-[4-(4-propanoylpiperazin-1-yl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 1-(4-methoxyphenyl)-5-[4-(4-propanoylpiperazin-1-yl)phenyl]pyrazole-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-[4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxyphenyl)-5-[4-(4-propanoylpiperazin-1-yl)phenyl]pyrazole-3-carboxylate Traditional Name: 1-(4-methoxyphenyl)-5-[4-(4-propionylpiperazino)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC(=NN3C4=CC=C(C=C4)OC)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC(=NN3C4=CC=C(C=C4)OC)C(=O)OCC

InChI

InChI=1S/C26H30N4O4/c1-4-25(31)29-16-14-28(15-17-29)20-8-6-19(7-9-20)24-18-23(26(32)34-5-2)27-30(24)21-10-12-22(33-3)13-11-21/h6-13,18H,4-5,14-17H2,1-3H3