7-(3-acetamidopyrrolidin-1-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-cinnoline-3-carboxylic acid

Systemtic Name: 7-(3-acetamidopyrrolidin-1-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-cinnoline-3-carboxylic acid Openeye Name: 7-(3-acetamidopyrrolidin-1-yl)-1-ethyl-6,8-difluoro-4-oxo-cinnoline-3-carboxylic acid CAS Name: 7-(3-acetamido-1-pyrrolidinyl)-1-ethyl-6,8-difluoro-4-oxo-3-cinnolinecarboxylic acid IUPAC Name: 7-(3-acetamidopyrrolidin-1-yl)-1-ethyl-6,8-difluoro-4-oxocinnoline-3-carboxylic acid Traditional Name: 7-(3-acetamidopyrrolidino)-1-ethyl-6,8-difluoro-4-keto-cinnoline-3-carboxylic acid Formula: C17H18F2N4O4 MolecularWeight: 380.346026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=C(C=C2C(=O)C(=N1)C(=O)O)F)N3CCC(C3)NC(=O)C)F

Isomeric SMILES

CCN1C2=C(C(=C(C=C2C(=O)C(=N1)C(=O)O)F)N3CCC(C3)NC(=O)C)F

InChI

InChI=1S/C17H18F2N4O4/c1-3-23-14-10(16(25)13(21-23)17(26)27)6-11(18)15(12(14)19)22-5-4-9(7-22)20-8(2)24/h6,9H,3-5,7H2,1-2H3,(H,20,24)(H,26,27)