ethyl 1-(2-methylphenyl)-5-[4-[4-(2-phenylmethoxyethanoyl)piperazin-1-yl]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-methylphenyl)-5-[4-[4-(2-phenylmethoxyethanoyl)piperazin-1-yl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[4-(2-benzyloxyacetyl)piperazin-1-yl]phenyl]-1-(o-tolyl)pyrazole-3-carboxylate CAS Name: 1-(2-methylphenyl)-5-[4-[4-(1-oxo-2-phenylmethoxyethyl)-1-piperazinyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methylphenyl)-5-[4-[4-(2-phenylmethoxyacetyl)piperazin-1-yl]phenyl]pyrazole-3-carboxylate Traditional Name: 5-[4-[4-(2-benzoxyacetyl)piperazino]phenyl]-1-(o-tolyl)pyrazole-3-carboxylic acid ethyl ester Formula: C32H34N4O4 MolecularWeight: 538.63676

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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)COCC4=CC=CC=C4)C5=CC=CC=C5C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)COCC4=CC=CC=C4)C5=CC=CC=C5C

InChI

InChI=1S/C32H34N4O4/c1-3-40-32(38)28-21-30(36(33-28)29-12-8-7-9-24(29)2)26-13-15-27(16-14-26)34-17-19-35(20-18-34)31(37)23-39-22-25-10-5-4-6-11-25/h4-16,21H,3,17-20,22-23H2,1-2H3