3-[[2-cyclopropyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[2-cyclopropyl-2-(phenylmethoxycarbonylamino)ethanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-2-cyclopropyl-acetyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 3-[[2-cyclopropyl-1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]-5-fluoro-4-oxopentanoic acid IUPAC Name: 3-[[2-cyclopropyl-2-(phenylmethoxycarbonylamino)acetyl]amino]-5-fluoro-4-oxopentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-2-cyclopropyl-acetyl]amino]-5-fluoro-4-keto-valeric acid Formula: C18H21FN2O6 MolecularWeight: 380.367543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC1C(C(=O)NC(CC(=O)O)C(=O)CF)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21FN2O6/c19-9-14(22)13(8-15(23)24)20-17(25)16(12-6-7-12)21-18(26)27-10-11-4-2-1-3-5-11/h1-5,12-13,16H,6-10H2,(H,20,25)(H,21,26)(H,23,24)