[1-cyclopropyl-7-fluoranyl-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)piperidin-1-yl]-4-oxidanylidene-quinolizin-3-yl] hydrogen carbonate hydrochloride

Systemtic Name: [1-cyclopropyl-7-fluoranyl-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)piperidin-1-yl]-4-oxidanylidene-quinolizin-3-yl] hydrogen carbonate hydrochloride Openeye Name: [1-cyclopropyl-7-fluoro-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)-1-piperidyl]-4-oxo-quinolizin-3-yl] hydrogen carbonate hydrochloride CAS Name: carbonic acid [1-cyclopropyl-7-fluoro-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)-1-piperidinyl]-4-oxo-3-quinolizinyl] ester hydrochloride IUPAC Name: [1-cyclopropyl-7-fluoro-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)piperidin-1-yl]-4-oxoquinolizin-3-yl] hydrogen carbonate hydrochloride Traditional Name: carbonic acid [1-cyclopropyl-7-fluoro-4-keto-9-methyl-8-[3-(2-methyl-1,3-dioxetan-2-yl)piperidino]quinolizin-3-yl] ester hydrochloride Formula: C22H26ClFN2O6 MolecularWeight: 468.903043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)OC(=O)O)C3CC3)F)N4CCCC(C4)C5(OCO5)C.Cl

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)OC(=O)O)C3CC3)F)N4CCCC(C4)C5(OCO5)C.Cl

InChI

InChI=1S/C22H25FN2O6.ClH/c1-12-18-15(13-5-6-13)8-17(31-21(27)28)20(26)25(18)10-16(23)19(12)24-7-3-4-14(9-24)22(2)29-11-30-22;/h8,10,13-14H,3-7,9,11H2,1-2H3,(H,27,28);1H