ethyl 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(3-phenylmethoxycyclobutyl)quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(3-phenylmethoxycyclobutyl)quinoline-3-carboxylate Openeye Name: ethyl 7-(3-benzyloxycyclobutyl)-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(3-phenylmethoxycyclobutyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-6-fluoro-4-oxo-7-(3-phenylmethoxycyclobutyl)quinoline-3-carboxylate Traditional Name: 7-(3-benzoxycyclobutyl)-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C26H26FNO4 MolecularWeight: 435.487343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)C3CC(C3)OCC4=CC=CC=C4)C5CC5

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)C3CC(C3)OCC4=CC=CC=C4)C5CC5

InChI

InChI=1S/C26H26FNO4/c1-2-31-26(30)22-14-28(18-8-9-18)24-13-20(23(27)12-21(24)25(22)29)17-10-19(11-17)32-15-16-6-4-3-5-7-16/h3-7,12-14,17-19H,2,8-11,15H2,1H3