2-[3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-(2,5-dimethyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-(2,5-dimethyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-(7-keto-2,5-dimethyl-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]ethyl-dimethyl-ammonium Formula: C26H29N2O4+ MolecularWeight: 433.51946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CCC(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CCC(=O)NCC[NH+](C)C

InChI

InChI=1S/C26H28N2O4/c1-16-19(10-11-24(29)27-12-13-28(3)4)26(30)32-22-15-23-21(14-20(16)22)25(17(2)31-23)18-8-6-5-7-9-18/h5-9,14-15H,10-13H2,1-4H3,(H,27,29)/p+1