ethyl (E)-2-acetamido-5-[(3E)-5-fluoranyl-3-[(5-methyl-1H-imidazol-4-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]pent-4-enoate

Systemtic Name: ethyl (E)-2-acetamido-5-[(3E)-5-fluoranyl-3-[(5-methyl-1H-imidazol-4-yl)methylidene]-2-oxidanylidene-1H-indol-4-yl]pent-4-enoate Openeye Name: ethyl (E)-2-acetamido-5-[(3E)-5-fluoro-3-[(5-methyl-1H-imidazol-4-yl)methylene]-2-oxo-indolin-4-yl]pent-4-enoate CAS Name: (E)-2-acetamido-5-[(3E)-5-fluoro-3-[(5-methyl-1H-imidazol-4-yl)methylidene]-2-oxo-1H-indol-4-yl]-4-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-2-acetamido-5-[(3E)-5-fluoro-3-[(5-methyl-1H-imidazol-4-yl)methylidene]-2-oxo-1H-indol-4-yl]pent-4-enoate Traditional Name: (E)-2-acetamido-5-[(3E)-5-fluoro-2-keto-3-[(5-methyl-1H-imidazol-4-yl)methylene]indolin-4-yl]pent-4-enoic acid ethyl ester Formula: C22H23FN4O4 MolecularWeight: 426.440823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=CC1=C(C=CC2=C1C(=CC3=C(NC=N3)C)C(=O)N2)F)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C/C=C/C1=C(C=CC2=C1/C(=C\C3=C(NC=N3)C)/C(=O)N2)F)NC(=O)C

InChI

InChI=1S/C22H23FN4O4/c1-4-31-22(30)18(26-13(3)28)7-5-6-14-16(23)8-9-17-20(14)15(21(29)27-17)10-19-12(2)24-11-25-19/h5-6,8-11,18H,4,7H2,1-3H3,(H,24,25)(H,26,28)(H,27,29)/b6-5+,15-10+