3-[2-(phenylmethyl)-2H-imidazol-4-yl]-2-[(1-pyridin-3-ylpiperidin-4-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[2-(phenylmethyl)-2H-imidazol-4-yl]-2-[(1-pyridin-3-ylpiperidin-4-yl)carbonylamino]propanoic acid Openeye Name: 3-(2-benzyl-2H-imidazol-4-yl)-2-[[1-(3-pyridyl)piperidine-4-carbonyl]amino]propanoic acid CAS Name: 2-[[oxo-[1-(3-pyridinyl)-4-piperidinyl]methyl]amino]-3-[2-(phenylmethyl)-2H-imidazol-4-yl]propanoic acid IUPAC Name: 3-(2-benzyl-2H-imidazol-4-yl)-2-[(1-pyridin-3-ylpiperidine-4-carbonyl)amino]propanoic acid Traditional Name: 3-(2-benzyl-2H-imidazol-4-yl)-2-[[1-(3-pyridyl)isonipecotoyl]amino]propionic acid Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=NC(N=C2)CC3=CC=CC=C3)C(=O)O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC(CC2=NC(N=C2)CC3=CC=CC=C3)C(=O)O)C4=CN=CC=C4

InChI

InChI=1S/C24H27N5O3/c30-23(18-8-11-29(12-9-18)20-7-4-10-25-16-20)28-21(24(31)32)14-19-15-26-22(27-19)13-17-5-2-1-3-6-17/h1-7,10,15-16,18,21-22H,8-9,11-14H2,(H,28,30)(H,31,32)