1-ethyl-6-fluoranyl-7-[2-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyrimidin-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[2-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyrimidin-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[2-[[benzyloxycarbonyl(methyl)amino]methyl]pyrimidin-4-yl]-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[2-[[methyl(phenylmethoxycarbonyl)amino]methyl]-4-pyrimidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[2-[[methyl(phenylmethoxycarbonyl)amino]methyl]pyrimidin-4-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-[[carbobenzoxy(methyl)amino]methyl]pyrimidin-4-yl]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C26H23FN4O5 MolecularWeight: 490.483023

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=NC=C3)CN(C)C(=O)OCC4=CC=CC=C4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=NC=C3)CN(C)C(=O)OCC4=CC=CC=C4)F)C(=O)O

InChI

InChI=1S/C26H23FN4O5/c1-3-31-13-19(25(33)34)24(32)18-11-20(27)17(12-22(18)31)21-9-10-28-23(29-21)14-30(2)26(35)36-15-16-7-5-4-6-8-16/h4-13H,3,14-15H2,1-2H3,(H,33,34)