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

Systemtic Name: 5-fluoranyl-3-[[3-(furan-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-pentanoic acid Openeye Name: 3-[[2-(benzyloxycarbonylamino)-3-(3-furyl)propanoyl]amino]-5-fluoro-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[3-(3-furanyl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[[3-(furan-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxopentanoic acid Traditional Name: 3-[[2-(benzyloxycarbonylamino)-3-(3-furyl)propanoyl]amino]-5-fluoro-4-keto-valeric acid Formula: C20H21FN2O7 MolecularWeight: 420.388343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=COC=C2)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=COC=C2)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C20H21FN2O7/c21-10-17(24)15(9-18(25)26)22-19(27)16(8-14-6-7-29-11-14)23-20(28)30-12-13-4-2-1-3-5-13/h1-7,11,15-16H,8-10,12H2,(H,22,27)(H,23,28)(H,25,26)