dimethyl-[[(3S)-4-oxidanylidene-2,3-dihydrochromen-3-yl]methyl]azanium

Systemtic Name: dimethyl-[[(3S)-4-oxidanylidene-2,3-dihydrochromen-3-yl]methyl]azanium Openeye Name: dimethyl-[[(3S)-4-oxochroman-3-yl]methyl]ammonium CAS Name: dimethyl-[[(3S)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]ammonium IUPAC Name: dimethyl-[[(3S)-4-oxo-2,3-dihydrochromen-3-yl]methyl]azanium Traditional Name: [(3S)-4-ketochroman-3-yl]methyl-dimethyl-ammonium Formula: C12H16NO2+ MolecularWeight: 206.26094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1COC2=CC=CC=C2C1=O

Isomeric SMILES

C[NH+](C)C[C@H]1COC2=CC=CC=C2C1=O

InChI

InChI=1S/C12H15NO2/c1-13(2)7-9-8-15-11-6-4-3-5-10(11)12(9)14/h3-6,9H,7-8H2,1-2H3/p+1/t9-/m0/s1