2-[[1-(2-azanyl-3-phenyl-propanoyl)piperidin-4-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[[1-(2-azanyl-3-phenyl-propanoyl)piperidin-4-yl]carbonylamino]propanoic acid Openeye Name: 2-[[1-(2-amino-3-phenyl-propanoyl)piperidine-4-carbonyl]amino]propanoic acid CAS Name: 2-[[[1-(2-amino-1-oxo-3-phenylpropyl)-4-piperidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[1-(2-amino-3-phenylpropanoyl)piperidine-4-carbonyl]amino]propanoic acid Traditional Name: 2-[(1-phenylalanylisonipecotoyl)amino]propionic acid Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1CCN(CC1)C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C(=O)O)NC(=O)C1CCN(CC1)C(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C18H25N3O4/c1-12(18(24)25)20-16(22)14-7-9-21(10-8-14)17(23)15(19)11-13-5-3-2-4-6-13/h2-6,12,14-15H,7-11,19H2,1H3,(H,20,22)(H,24,25)