[(2S)-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-(hydroxymethyl)-2-[(4-methyl-2-oxo-chromen-7-yl)amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-hydroxy-1-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-hydroxy-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-2-[(2-keto-4-methyl-chromen-7-yl)amino]-1-methylol-ethyl]ammonium Formula: C13H15N2O4+ MolecularWeight: 263.2692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CO)[NH3+]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CO)[NH3+]

InChI

InChI=1S/C13H14N2O4/c1-7-4-12(17)19-11-5-8(2-3-9(7)11)15-13(18)10(14)6-16/h2-5,10,16H,6,14H2,1H3,(H,15,18)/p+1/t10-/m0/s1