3-[2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[(6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(6-chloro-3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(6-chloro-2-keto-3,4-dimethyl-chromen-7-yl)oxyacetyl]amino]propyl-dimethyl-ammonium Formula: C18H24ClN2O4+ MolecularWeight: 367.84716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCCC[NH+](C)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCCC[NH+](C)C)C

InChI

InChI=1S/C18H23ClN2O4/c1-11-12(2)18(23)25-15-9-16(14(19)8-13(11)15)24-10-17(22)20-6-5-7-21(3)4/h8-9H,5-7,10H2,1-4H3,(H,20,22)/p+1