3-[[3-(dimethylamino)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[3-(dimethylamino)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-3-(dimethylamino)propanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[3-(dimethylamino)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[[3-(dimethylamino)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-3-(dimethylamino)propanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C18H24FN3O6 MolecularWeight: 397.398063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CN(C)CC(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H24FN3O6/c1-22(2)10-14(17(26)20-13(8-16(24)25)15(23)9-19)21-18(27)28-11-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3,(H,20,26)(H,21,27)(H,24,25)