5-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-5-oxo-pentanoic acid CAS Name: 5-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid IUPAC Name: 5-[3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid Traditional Name: 5-[3,5-bis(4-methoxyphenyl)-2-pyrazolin-1-yl]-5-keto-valeric acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CCCC(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CCCC(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O5/c1-28-17-10-6-15(7-11-17)19-14-20(16-8-12-18(29-2)13-9-16)24(23-19)21(25)4-3-5-22(26)27/h6-13,20H,3-5,14H2,1-2H3,(H,26,27)