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

Systemtic Name: dimethyl-[3-[3-(5-methyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]propyl]azanium Openeye Name: dimethyl-[3-[3-(5-methyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]propyl]ammonium CAS Name: dimethyl-[3-[[3-(5-methyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[3-(5-methyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]propyl]azanium Traditional Name: 3-[3-(7-keto-5-methyl-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]propyl-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)CCC(=O)NCCC[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O4/c1-17-19(10-11-25(29)27-12-7-13-28(2)3)26(30)32-24-15-23-21(14-20(17)24)22(16-31-23)18-8-5-4-6-9-18/h4-6,8-9,14-16H,7,10-13H2,1-3H3,(H,27,29)/p+1