dimethyl-[1-[[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexyl]azanium Openeye Name: dimethyl-[1-[[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexyl]ammonium CAS Name: dimethyl-[1-[[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]methyl]cyclohexyl]ammonium IUPAC Name: dimethyl-[1-[[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]methyl]cyclohexyl]azanium Traditional Name: [1-[[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C21H29N2O4+ MolecularWeight: 373.46596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC3(CCCCC3)[NH+](C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCC3(CCCCC3)[NH+](C)C

InChI

InChI=1S/C21H28N2O4/c1-15-11-20(25)27-18-12-16(7-8-17(15)18)26-13-19(24)22-14-21(23(2)3)9-5-4-6-10-21/h7-8,11-12H,4-6,9-10,13-14H2,1-3H3,(H,22,24)/p+1