3-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylazaniumyl]propanoate

Systemtic Name: 3-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methylazaniumyl]propanoate Openeye Name: 3-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methylammonio]propanoate CAS Name: 3-[(7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methylammonio]propanoate IUPAC Name: 3-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methylazaniumyl]propanoate Traditional Name: 3-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methylammonio]propionate Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO5/c1-8-6-13(19)20-14-9(8)2-3-11(16)10(14)7-15-5-4-12(17)18/h2-3,6,15-16H,4-5,7H2,1H3,(H,17,18)