3-(10-fluoranyl-9-methoxy-4-oxidanylidene-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-oxidanyl-pentanoic acid

Systemtic Name: 3-(10-fluoranyl-9-methoxy-4-oxidanylidene-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-oxidanyl-pentanoic acid Openeye Name: 3-(10-fluoro-9-methoxy-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-hydroxy-pentanoic acid CAS Name: 3-(10-fluoro-9-methoxy-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-hydroxypentanoic acid IUPAC Name: 3-(10-fluoro-9-methoxy-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-hydroxypentanoic acid Traditional Name: 3-(10-fluoro-4-keto-9-methoxy-6,7-dihydro-1H-indolizino[1,2-b]quinolin-10-ium-2-yl)-3-hydroxy-valeric acid Formula: C21H22FN2O5+ MolecularWeight: 401.408183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)(C1=CC(=O)C2=NC3=C4CCC=C([N+]4(C=C3C=C2C1)F)OC)O

Isomeric SMILES

CCC(CC(=O)O)(C1=CC(=O)C2=NC3=C4CCC=C([N+]4(C=C3C=C2C1)F)OC)O

InChI

InChI=1S/C21H21FN2O5/c1-3-21(28,10-18(26)27)14-8-12-7-13-11-24(22)15(5-4-6-17(24)29-2)19(13)23-20(12)16(25)9-14/h6-7,9,11,28H,3-5,8,10H2,1-2H3/p+1