1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(E)-3-piperazin-1-ylprop-1-enyl]piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(E)-3-piperazin-1-ylprop-1-enyl]piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[(E)-3-piperazin-1-ylprop-1-enyl]piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[(E)-3-(1-piperazinyl)prop-1-enyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[(E)-3-piperazin-1-ylprop-1-enyl]piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[(E)-3-piperazinoprop-1-enyl]piperazino]quinoline-3-carboxylic acid Formula: C24H30FN5O3 MolecularWeight: 455.525103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C=CCN5CCNCC5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)/C=C/CN5CCNCC5)F)C(=O)O

InChI

InChI=1S/C24H30FN5O3/c25-20-14-18-21(30(17-2-3-17)16-19(23(18)31)24(32)33)15-22(20)29-12-10-28(11-13-29)7-1-6-27-8-4-26-5-9-27/h1,7,14-17,26H,2-6,8-13H2,(H,32,33)/b7-1+