5-azanyl-1-cyclopropyl-7-[3-(dimethylaminomethyl)piperazin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[3-(dimethylaminomethyl)piperazin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)piperazin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)-1-piperazinyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)piperazin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-7-[3-(dimethylaminomethyl)piperazino]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H25F2N5O3 MolecularWeight: 421.441006

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CN(CCN1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

Isomeric SMILES

CN(C)CC1CN(CCN1)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

InChI

InChI=1S/C20H25F2N5O3/c1-25(2)7-10-8-26(6-5-24-10)18-14(21)16(23)13-17(15(18)22)27(11-3-4-11)9-12(19(13)28)20(29)30/h9-11,24H,3-8,23H2,1-2H3,(H,29,30)