8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)-1-pyrrolidinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-cyano-1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidino]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H23FN4O3 MolecularWeight: 398.430723

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1CCN(C1)C2=C(C=C3C(=C2C#N)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCNCC1CCN(C1)C2=C(C=C3C(=C2C#N)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C21H23FN4O3/c1-2-24-9-12-5-6-25(10-12)19-15(8-23)18-14(7-17(19)22)20(27)16(21(28)29)11-26(18)13-3-4-13/h7,11-13,24H,2-6,9-10H2,1H3,(H,28,29)