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

Systemtic Name: 7-[3-(1-azanylethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethynyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(1-aminoethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(1-aminoethyl)-1-pyrrolidinyl]-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(1-aminoethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(1-aminoethyl)pyrrolidino]-1-cyclopropyl-8-ethynyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(C1)C2=C(C=C3C(=C2C#C)N(C=C(C3=O)C(=O)O)C4CC4)F)N

Isomeric SMILES

CC(C1CCN(C1)C2=C(C=C3C(=C2C#C)N(C=C(C3=O)C(=O)O)C4CC4)F)N

InChI

InChI=1S/C21H22FN3O3/c1-3-14-18-15(20(26)16(21(27)28)10-25(18)13-4-5-13)8-17(22)19(14)24-7-6-12(9-24)11(2)23/h1,8,10-13H,4-7,9,23H2,2H3,(H,27,28)