3-[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[(1,4-dioxaspiro[4.5]decan-8-ylamino)methyl]benzoyl]amino]propionic acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1NCC3=CC=C(C=C3)C(=O)NCCC(=O)O)OCCO2

Isomeric SMILES

C1CC2(CCC1NCC3=CC=C(C=C3)C(=O)NCCC(=O)O)OCCO2

InChI

InChI=1S/C19H26N2O5/c22-17(23)7-10-20-18(24)15-3-1-14(2-4-15)13-21-16-5-8-19(9-6-16)25-11-12-26-19/h1-4,16,21H,5-13H2,(H,20,24)(H,22,23)