3-(1H-imidazol-5-yl)-2-[3-(octoxycarbonylamino)propanoylamino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[3-(octoxycarbonylamino)propanoylamino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-[3-(octoxycarbonylamino)propanoylamino]propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[[3-[[octoxy(oxo)methyl]amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[3-(octoxycarbonylamino)propanoylamino]propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[3-(octoxycarbonylamino)propanoylamino]propionic acid Formula: C18H30N4O5 MolecularWeight: 382.4546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)NCCC(=O)NC(CC1=CN=CN1)C(=O)O

InChI

InChI=1S/C18H30N4O5/c1-2-3-4-5-6-7-10-27-18(26)20-9-8-16(23)22-15(17(24)25)11-14-12-19-13-21-14/h12-13,15H,2-11H2,1H3,(H,19,21)(H,20,26)(H,22,23)(H,24,25)