7-[3-[(tert-butylamino)methyl]-3-oxidanyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-[(tert-butylamino)methyl]-3-oxidanyl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[(tert-butylamino)methyl]-3-hydroxy-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[(tert-butylamino)methyl]-3-hydroxy-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[(tert-butylamino)methyl]-3-hydroxypyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[(tert-butylamino)methyl]-3-hydroxy-pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H28FN3O4 MolecularWeight: 417.473823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1(CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)O

Isomeric SMILES

CC(C)(C)NCC1(CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)O

InChI

InChI=1S/C22H28FN3O4/c1-21(2,3)24-11-22(30)6-7-25(12-22)18-9-17-14(8-16(18)23)19(27)15(20(28)29)10-26(17)13-4-5-13/h8-10,13,24,30H,4-7,11-12H2,1-3H3,(H,28,29)