2-[1-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[3-(m-tolyl)-1-phenyl-pyrazole-4-carbonyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[[3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[3-(3-methylphenyl)-1-phenylpyrazole-4-carbonyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[3-(m-tolyl)-1-phenyl-pyrazole-4-carbonyl]-4-piperidyl]acetic acid Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N3CCC(CC3)CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N3CCC(CC3)CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O3/c1-17-6-5-7-19(14-17)23-21(16-27(25-23)20-8-3-2-4-9-20)24(30)26-12-10-18(11-13-26)15-22(28)29/h2-9,14,16,18H,10-13,15H2,1H3,(H,28,29)