1-cyclopropyl-6,8-bis(fluoranyl)-7-(3-methyl-4-propan-2-yl-piperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-7-(3-methyl-4-propan-2-yl-piperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-7-(4-isopropyl-3-methyl-piperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-7-(3-methyl-4-propan-2-yl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-7-(3-methyl-4-propan-2-ylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-7-(4-isopropyl-3-methyl-piperazino)-4-keto-quinoline-3-carboxylic acid Formula: C21H25F2N3O3 MolecularWeight: 405.438306

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C)C)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CC1CN(CCN1C(C)C)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C21H25F2N3O3/c1-11(2)25-7-6-24(9-12(25)3)19-16(22)8-14-18(17(19)23)26(13-4-5-13)10-15(20(14)27)21(28)29/h8,10-13H,4-7,9H2,1-3H3,(H,28,29)