3-[2-[4-(phenylmethyl)phenoxy]ethyl-piperidin-4-ylcarbonyl-amino]propanoic acid

Systemtic Name: 3-[2-[4-(phenylmethyl)phenoxy]ethyl-piperidin-4-ylcarbonyl-amino]propanoic acid Openeye Name: 3-[2-(4-benzylphenoxy)ethyl-(piperidine-4-carbonyl)amino]propanoic acid CAS Name: 3-[[oxo(4-piperidinyl)methyl]-[2-[4-(phenylmethyl)phenoxy]ethyl]amino]propanoic acid IUPAC Name: 3-[2-(4-benzylphenoxy)ethyl-(piperidine-4-carbonyl)amino]propanoic acid Traditional Name: 3-[2-(4-benzylphenoxy)ethyl-isonipecotoyl-amino]propionic acid Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)N(CCC(=O)O)CCOC2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CNCCC1C(=O)N(CCC(=O)O)CCOC2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O4/c27-23(28)12-15-26(24(29)21-10-13-25-14-11-21)16-17-30-22-8-6-20(7-9-22)18-19-4-2-1-3-5-19/h1-9,21,25H,10-18H2,(H,27,28)