[3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-(3-methylbutyl)azanium

Systemtic Name: [3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-(3-methylbutyl)azanium Openeye Name: [7-hydroxy-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-8-yl]methyl-isopentyl-ammonium CAS Name: [7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-8-yl]methyl-(3-methylbutyl)ammonium IUPAC Name: [7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-8-yl]methyl-(3-methylbutyl)azanium Traditional Name: [7-hydroxy-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-8-yl]methyl-isoamyl-ammonium Formula: C19H26NO5+ MolecularWeight: 348.41344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CCC(C)C)O)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CCC(C)C)O)CC(=O)OC

InChI

InChI=1S/C19H25NO5/c1-11(2)7-8-20-10-15-16(21)6-5-13-12(3)14(9-17(22)24-4)19(23)25-18(13)15/h5-6,11,20-21H,7-10H2,1-4H3/p+1