(3-ethanoyl-7-oxidanyl-2-oxidanylidene-chromen-5-yl)methyl-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (3-ethanoyl-7-oxidanyl-2-oxidanylidene-chromen-5-yl)methyl-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (3-acetyl-7-hydroxy-2-oxo-chromen-5-yl)methyl-[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl]ammonium CAS Name: (3-acetyl-7-hydroxy-2-oxo-1-benzopyran-5-yl)methyl-[(2S)-1-ethoxy-1-oxopropan-2-yl]ammonium IUPAC Name: (3-acetyl-7-hydroxy-2-oxochromen-5-yl)methyl-[(2S)-1-ethoxy-1-oxopropan-2-yl]azanium Traditional Name: (3-acetyl-7-hydroxy-2-keto-chromen-5-yl)methyl-[(1S)-2-ethoxy-2-keto-1-methyl-ethyl]ammonium Formula: C17H20NO6+ MolecularWeight: 334.3438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)[NH2+]CC1=CC(=CC2=C1C=C(C(=O)O2)C(=O)C)O

Isomeric SMILES

CCOC(=O)[C@H](C)[NH2+]CC1=CC(=CC2=C1C=C(C(=O)O2)C(=O)C)O

InChI

InChI=1S/C17H19NO6/c1-4-23-16(21)9(2)18-8-11-5-12(20)6-15-14(11)7-13(10(3)19)17(22)24-15/h5-7,9,18,20H,4,8H2,1-3H3/p+1/t9-/m0/s1