5-[3-(1,3-diphenylpyrazol-4-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-(1,3-diphenylpyrazol-4-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[3-(1,3-diphenylpyrazol-4-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-5-oxo-pentanoic acid CAS Name: 5-[3-(1,3-diphenyl-4-pyrazolyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoic acid IUPAC Name: 5-[3-(1,3-diphenylpyrazol-4-yl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoic acid Traditional Name: 5-[5-(1,3-diphenylpyrazol-4-yl)-3-(4-methoxyphenyl)-3-pyrazolin-1-yl]-5-keto-valeric acid Formula: C30H28N4O4 MolecularWeight: 508.56772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(N(N2)C(=O)CCCC(=O)O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(N(N2)C(=O)CCCC(=O)O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H28N4O4/c1-38-24-17-15-21(16-18-24)26-19-27(34(31-26)28(35)13-8-14-29(36)37)25-20-33(23-11-6-3-7-12-23)32-30(25)22-9-4-2-5-10-22/h2-7,9-12,15-20,27,31H,8,13-14H2,1H3,(H,36,37)