5-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-1,3-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-1,3-dihydropyrazol-2-yl]-5-oxo-pentanoate CAS Name: 5-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenyl-4-pyrazolyl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoate IUPAC Name: 5-[(3R)-5-(4-bromophenyl)-3-(1,3-diphenylpyrazol-4-yl)-1,3-dihydropyrazol-2-yl]-5-oxopentanoate Traditional Name: 5-[(5R)-3-(4-bromophenyl)-5-(1,3-diphenylpyrazol-4-yl)-3-pyrazolin-1-yl]-5-keto-valerate Formula: C29H24BrN4O3- MolecularWeight: 556.42986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C3C=C(NN3C(=O)CCCC(=O)[O-])C4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2[C@H]3C=C(NN3C(=O)CCCC(=O)[O-])C4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C29H25BrN4O3/c30-22-16-14-20(15-17-22)25-18-26(34(31-25)27(35)12-7-13-28(36)37)24-19-33(23-10-5-2-6-11-23)32-29(24)21-8-3-1-4-9-21/h1-6,8-11,14-19,26,31H,7,12-13H2,(H,36,37)/p-1/t26-/m1/s1