2-hydroxyethyl-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]azanium

Systemtic Name: 2-hydroxyethyl-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]azanium Openeye Name: 2-hydroxyethyl-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]ammonium CAS Name: 2-hydroxyethyl-[(7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl]ammonium IUPAC Name: 2-hydroxyethyl-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]azanium Traditional Name: 2-hydroxyethyl-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]ammonium Formula: C13H16NO4+ MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]CCO)O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]CCO)O

InChI

InChI=1S/C13H15NO4/c1-8-6-12(17)18-13-9(8)2-3-11(16)10(13)7-14-4-5-15/h2-3,6,14-16H,4-5,7H2,1H3/p+1