3-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylpyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[3-(4-benzylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3-(4-benzylpiperidine-1-carbonyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[3-(4-benzylpiperidine-1-carbonyl)pyrazol-1-yl]propionic acid Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NN(C=C3)CCC(=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NN(C=C3)CCC(=O)O

InChI

InChI=1S/C19H23N3O3/c23-18(24)9-13-22-12-8-17(20-22)19(25)21-10-6-16(7-11-21)14-15-4-2-1-3-5-15/h1-5,8,12,16H,6-7,9-11,13-14H2,(H,23,24)