ditert-butyl 2-[4-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-methoxycarbonyl-phenyl]-2-fluoranyl-propanedioate

Systemtic Name: ditert-butyl 2-[4-[(Z)-2-acetamido-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-methoxycarbonyl-phenyl]-2-fluoranyl-propanedioate Openeye Name: ditert-butyl 2-[4-[(Z)-2-acetamido-3-methoxy-3-oxo-prop-1-enyl]-2-methoxycarbonyl-phenyl]-2-fluoro-propanedioate CAS Name: 2-[4-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-2-methoxycarbonylphenyl]-2-fluoropropanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[4-[(Z)-2-acetamido-3-methoxy-3-oxoprop-1-enyl]-2-methoxycarbonylphenyl]-2-fluoropropanedioate Traditional Name: 2-[4-[(Z)-2-acetamido-3-keto-3-methoxy-prop-1-enyl]-2-carbomethoxy-phenyl]-2-fluoro-malonic acid ditert-butyl ester Formula: C25H32FNO9 MolecularWeight: 509.521283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC(=C(C=C1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)F)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)N/C(=C\C1=CC(=C(C=C1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)F)C(=O)OC)/C(=O)OC

InChI

InChI=1S/C25H32FNO9/c1-14(28)27-18(20(30)34-9)13-15-10-11-17(16(12-15)19(29)33-8)25(26,21(31)35-23(2,3)4)22(32)36-24(5,6)7/h10-13H,1-9H3,(H,27,28)/b18-13-