3-[[1-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyethanoyl]piperidin-3-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[1-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyethanoyl]piperidin-3-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-[2-[(1-benzyloxycarbonyl-4-piperidyl)oxy]acetyl]piperidine-3-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[1-[1-oxo-2-[(1-phenylmethoxycarbonyl-4-piperidinyl)oxy]ethyl]-3-piperidinyl]methyl]amino]propanoic acid IUPAC Name: 3-[[1-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyacetyl]piperidine-3-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-[2-[(1-carbobenzoxy-4-piperidyl)oxy]acetyl]nipecotoyl]amino]propionic acid Formula: C24H33N3O7 MolecularWeight: 475.53472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)COC2CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)NCCC(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)COC2CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)NCCC(=O)O

InChI

InChI=1S/C24H33N3O7/c28-21(27-12-4-7-19(15-27)23(31)25-11-8-22(29)30)17-33-20-9-13-26(14-10-20)24(32)34-16-18-5-2-1-3-6-18/h1-3,5-6,19-20H,4,7-17H2,(H,25,31)(H,29,30)