(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]azanium

Systemtic Name: (3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]azanium Openeye Name: (1-carboxy-2-methyl-propyl)-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]ammonium CAS Name: (7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl-(1-hydroxy-3-methyl-1-oxobutan-2-yl)ammonium IUPAC Name: (1-hydroxy-3-methyl-1-oxobutan-2-yl)-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]azanium Traditional Name: (1-carboxy-2-methyl-propyl)-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]ammonium Formula: C16H20NO5+ MolecularWeight: 306.3337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO5/c1-8(2)14(16(20)21)17-7-11-12(18)5-4-10-9(3)6-13(19)22-15(10)11/h4-6,8,14,17-18H,7H2,1-3H3,(H,20,21)/p+1