(2R)-2-[5-methoxy-7-methyl-3,4,6-tris(oxidanyl)chromen-2-ylidene]azaniumylpropanoate

Systemtic Name: (2R)-2-[5-methoxy-7-methyl-3,4,6-tris(oxidanyl)chromen-2-ylidene]azaniumylpropanoate Openeye Name: (2R)-2-(3,4,6-trihydroxy-5-methoxy-7-methyl-chromen-2-ylidene)ammoniopropanoate CAS Name: (2R)-2-[(3,4,6-trihydroxy-5-methoxy-7-methyl-1-benzopyran-2-ylidene)ammonio]propanoate IUPAC Name: (2R)-2-(3,4,6-trihydroxy-5-methoxy-7-methylchromen-2-ylidene)azaniumylpropanoate Traditional Name: (2R)-2-(3,4,6-trihydroxy-5-methoxy-7-methyl-chromen-2-ylidene)ammoniopropionate Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=[NH+]C(C)C(=O)[O-])O2)O)O)C(=C1O)OC

Isomeric SMILES

CC1=CC2=C(C(=C(C(=[NH+][C@H](C)C(=O)[O-])O2)O)O)C(=C1O)OC

InChI

InChI=1S/C14H15NO7/c1-5-4-7-8(12(21-3)9(5)16)10(17)11(18)13(22-7)15-6(2)14(19)20/h4,6,16-18H,1-3H3,(H,19,20)/t6-/m1/s1