7-[(E)-3-(dimethylamino)prop-2-enoyl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(E)-3-(dimethylamino)prop-2-enoyl]-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(E)-3-(dimethylamino)prop-2-enoyl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(E)-3-(dimethylamino)-1-oxoprop-2-enyl]-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(E)-3-(dimethylamino)prop-2-enoyl]-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(E)-3-(dimethylamino)acryloyl]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C17H17FN2O4 MolecularWeight: 332.326283

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=O)C=CN(C)C)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=O)/C=C/N(C)C)F)C(=O)O

InChI

InChI=1S/C17H17FN2O4/c1-4-20-9-12(17(23)24)16(22)11-7-13(18)10(8-14(11)20)15(21)5-6-19(2)3/h5-9H,4H2,1-3H3,(H,23,24)/b6-5+