dimethyl-[3-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]propyl]azanium Openeye Name: 3-[[2-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]propyl-dimethyl-ammonium Formula: C17H23N2O4+ MolecularWeight: 319.37552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O4/c1-11-13-6-5-12(20)9-15(13)23-17(22)14(11)10-16(21)18-7-4-8-19(2)3/h5-6,9,20H,4,7-8,10H2,1-3H3,(H,18,21)/p+1