1-cyclopropyl-6,8-bis(fluoranyl)-7-[(4-methylpiperazin-1-yl)methyl]-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6,8-bis(fluoranyl)-7-[(4-methylpiperazin-1-yl)methyl]-4-oxidanylidene-8,8a-dihydroquinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6,8-difluoro-7-[(4-methylpiperazin-1-yl)methyl]-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6,8-difluoro-7-[(4-methyl-1-piperazinyl)methyl]-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid IUPAC Name: 1-cyclopropyl-6,8-difluoro-7-[(4-methylpiperazin-1-yl)methyl]-4-oxo-8,8a-dihydroquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6,8-difluoro-4-keto-7-[(4-methylpiperazino)methyl]-8,8a-dihydroquinoline-3-carboxylic acid Formula: C19H23F2N3O3 MolecularWeight: 379.401026

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=C3C(C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C19H23F2N3O3/c1-22-4-6-23(7-5-22)9-13-15(20)8-12-17(16(13)21)24(11-2-3-11)10-14(18(12)25)19(26)27/h8,10-11,16-17H,2-7,9H2,1H3,(H,26,27)