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

Systemtic Name: 6,8-bis(fluoranyl)-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-1-propan-2-yl-quinoline-3-carboxylic acid Openeye Name: 6,8-difluoro-1-isopropyl-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-1-propan-2-yl-3-quinolinecarboxylic acid IUPAC Name: 6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1-propan-2-ylquinoline-3-carboxylic acid Traditional Name: 6,8-difluoro-1-isopropyl-4-keto-7-(3-methylpiperazino)quinoline-3-carboxylic acid Formula: C18H21F2N3O3 MolecularWeight: 365.374446

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C(C)C)F

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C(C)C)F

InChI

InChI=1S/C18H21F2N3O3/c1-9(2)23-8-12(18(25)26)17(24)11-6-13(19)16(14(20)15(11)23)22-5-4-21-10(3)7-22/h6,8-10,21H,4-5,7H2,1-3H3,(H,25,26)