ethyl 1-cyclopropyl-8-[4-fluoranyl-5-(hydroxymethyl)thiophen-2-yl]-9-methyl-4-oxidanylidene-quinolizine-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-8-[4-fluoranyl-5-(hydroxymethyl)thiophen-2-yl]-9-methyl-4-oxidanylidene-quinolizine-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-8-[4-fluoro-5-(hydroxymethyl)-2-thienyl]-9-methyl-4-oxo-quinolizine-3-carboxylate CAS Name: 1-cyclopropyl-8-[4-fluoro-5-(hydroxymethyl)-2-thiophenyl]-9-methyl-4-oxo-3-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-8-[4-fluoro-5-(hydroxymethyl)thiophen-2-yl]-9-methyl-4-oxoquinolizine-3-carboxylate Traditional Name: 1-cyclopropyl-8-(4-fluoro-5-methylol-2-thienyl)-4-keto-9-methyl-quinolizine-3-carboxylic acid ethyl ester Formula: C21H20FNO4S MolecularWeight: 401.451203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC(=C(S3)CO)F)C)C4CC4

Isomeric SMILES

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC(=C(S3)CO)F)C)C4CC4

InChI

InChI=1S/C21H20FNO4S/c1-3-27-21(26)15-8-14(12-4-5-12)19-11(2)13(6-7-23(19)20(15)25)17-9-16(22)18(10-24)28-17/h6-9,12,24H,3-5,10H2,1-2H3