2-[1-[1-(4-cyanophenyl)-2-methyl-5-oxidanylidene-3-(4-pyridin-2-ylphenyl)pyrazol-4-yl]carbonylpiperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[1-(4-cyanophenyl)-2-methyl-5-oxidanylidene-3-(4-pyridin-2-ylphenyl)pyrazol-4-yl]carbonylpiperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[1-(4-cyanophenyl)-2-methyl-5-oxo-3-[4-(2-pyridyl)phenyl]pyrazole-4-carbonyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[[1-(4-cyanophenyl)-2-methyl-5-oxo-3-[4-(2-pyridinyl)phenyl]-4-pyrazolyl]-oxomethyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[1-(4-cyanophenyl)-2-methyl-5-oxo-3-(4-pyridin-2-ylphenyl)pyrazole-4-carbonyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[1-(4-cyanophenyl)-5-keto-2-methyl-3-[4-(2-pyridyl)phenyl]-3-pyrazoline-4-carbonyl]-4-piperidyl]oxy]acetic acid Formula: C30H27N5O5 MolecularWeight: 537.56588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=C(C=C2)C#N)C(=O)N3CCC(CC3)OCC(=O)O)C4=CC=C(C=C4)C5=CC=CC=N5

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=C(C=C2)C#N)C(=O)N3CCC(CC3)OCC(=O)O)C4=CC=C(C=C4)C5=CC=CC=N5

InChI

InChI=1S/C30H27N5O5/c1-33-28(22-9-7-21(8-10-22)25-4-2-3-15-32-25)27(30(39)35(33)23-11-5-20(18-31)6-12-23)29(38)34-16-13-24(14-17-34)40-19-26(36)37/h2-12,15,24H,13-14,16-17,19H2,1H3,(H,36,37)