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

Systemtic Name: 2-[3-(dodecoxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[3-(dodecoxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[3-[[dodecoxy(oxo)methyl]amino]-1-oxopropyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[3-(dodecoxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[3-(lauryloxycarbonylamino)propanoylamino]propionic acid Formula: C22H38N4O5 MolecularWeight: 438.56092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38N4O5/c1-2-3-4-5-6-7-8-9-10-11-14-31-22(30)24-13-12-20(27)26-19(21(28)29)15-18-16-23-17-25-18/h16-17,19H,2-15H2,1H3,(H,23,25)(H,24,30)(H,26,27)(H,28,29)