[1-(2,6-dimethylmorpholin-4-yl)-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: [1-(2,6-dimethylmorpholin-4-yl)-1-oxidanylidene-propan-2-yl] 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: [2-(2,6-dimethylmorpholin-4-yl)-1-methyl-2-oxo-ethyl] 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolecarboxylic acid [1-(2,6-dimethyl-4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,6-dimethylmorpholin-4-yl)-1-oxopropan-2-yl] 4-(3,4-dimethoxyphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazole-3-carboxylic acid [2-(2,6-dimethylmorpholino)-2-keto-1-methyl-ethyl] ester Formula: C27H31N3O6 MolecularWeight: 493.55154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)C(C)OC(=O)C2=NN(C=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CC(O1)C)C(=O)C(C)OC(=O)C2=NN(C=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O6/c1-17-14-29(15-18(2)35-17)26(31)19(3)36-27(32)25-22(16-30(28-25)21-9-7-6-8-10-21)20-11-12-23(33-4)24(13-20)34-5/h6-13,16-19H,14-15H2,1-5H3