4-[(3R)-5-(3,4-dimethoxyphenyl)-3-(4-dimethylaminophenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3R)-5-(3,4-dimethoxyphenyl)-3-(4-dimethylaminophenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-5-(3,4-dimethoxyphenyl)-3-(4-dimethylaminophenyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-5-(3,4-dimethoxyphenyl)-3-(4-dimethylaminophenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-5-(3,4-dimethoxyphenyl)-3-(4-dimethylaminophenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-[(5R)-3-(3,4-dimethoxyphenyl)-5-(4-dimethylaminophenyl)-2-pyrazolin-1-yl]-4-keto-butyrate Formula: C23H26N3O5- MolecularWeight: 424.46964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2CC(=NN2C(=O)CCC(=O)[O-])C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CCC(=O)[O-])C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H27N3O5/c1-25(2)17-8-5-15(6-9-17)19-14-18(24-26(19)22(27)11-12-23(28)29)16-7-10-20(30-3)21(13-16)31-4/h5-10,13,19H,11-12,14H2,1-4H3,(H,28,29)/p-1/t19-/m1/s1