5-[(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-1,3-dihydropyrazol-2-yl]-5-oxo-pentanoate CAS Name: 5-[(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoate IUPAC Name: 5-[(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoate Traditional Name: 5-[(5S)-3-(3,4-dimethoxyphenyl)-5-(4-ethylphenyl)-3-pyrazolin-1-yl]-5-keto-valerate Formula: C24H27N2O5- MolecularWeight: 423.48158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C=C(NN2C(=O)CCCC(=O)[O-])C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H]2C=C(NN2C(=O)CCCC(=O)[O-])C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H28N2O5/c1-4-16-8-10-17(11-9-16)20-15-19(18-12-13-21(30-2)22(14-18)31-3)25-26(20)23(27)6-5-7-24(28)29/h8-15,20,25H,4-7H2,1-3H3,(H,28,29)/p-1/t20-/m0/s1