3-[7-bromanyl-1-(4-fluorophenyl)-3,9-bis(oxidanylidene)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-azanium

Systemtic Name: 3-[7-bromanyl-1-(4-fluorophenyl)-3,9-bis(oxidanylidene)-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-azanium Openeye Name: 3-[7-bromo-1-(4-fluorophenyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium CAS Name: 3-[7-bromo-1-(4-fluorophenyl)-3,9-dioxo-1H-[1]benzopyrano[2,3-c]pyrrol-2-yl]propyl-diethylammonium IUPAC Name: 3-[7-bromo-1-(4-fluorophenyl)-3,9-dioxo-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethylazanium Traditional Name: 3-[7-bromo-1-(4-fluorophenyl)-3,9-diketo-1H-chromeno[2,3-c]pyrrol-2-yl]propyl-diethyl-ammonium Formula: C24H25BrFN2O3+ MolecularWeight: 488.369303

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C2=C(C1=O)OC3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

CC[NH+](CC)CCCN1C(C2=C(C1=O)OC3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H24BrFN2O3/c1-3-27(4-2)12-5-13-28-21(15-6-9-17(26)10-7-15)20-22(29)18-14-16(25)8-11-19(18)31-23(20)24(28)30/h6-11,14,21H,3-5,12-13H2,1-2H3/p+1