1-[4-(3-methyl-5-phenyl-pyrazol-1-yl)phenyl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[4-(3-methyl-5-phenyl-pyrazol-1-yl)phenyl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-[4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoyl]piperidine-4-carboxylic acid CAS Name: 1-[[4-(3-methyl-5-phenyl-1-pyrazolyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-(3-methyl-5-phenylpyrazol-1-yl)benzoyl]piperidine-4-carboxylic acid Traditional Name: 1-[4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoyl]isonipecotic acid Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C23H23N3O3/c1-16-15-21(17-5-3-2-4-6-17)26(24-16)20-9-7-18(8-10-20)22(27)25-13-11-19(12-14-25)23(28)29/h2-10,15,19H,11-14H2,1H3,(H,28,29)