2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]ethyl]ammonium CAS Name: 2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]ethyl]ammonium Formula: C20H29N2O4+ MolecularWeight: 361.45526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C20H28N2O4/c1-13(2)22(14(3)4)9-8-21-19(23)12-25-16-6-7-17-15(5)10-20(24)26-18(17)11-16/h6-7,10-11,13-14H,8-9,12H2,1-5H3,(H,21,23)/p+1