3-[[(2S)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]propanoate

Systemtic Name: 3-[[(2S)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxypropanoyl]amino]propanoate Openeye Name: 3-[[(2S)-2-(3,4,7-trimethyl-2-oxo-chromen-5-yl)oxypropanoyl]amino]propanoate CAS Name: 3-[[(2S)-1-oxo-2-[(3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl)oxy]propyl]amino]propanoate IUPAC Name: 3-[[(2S)-2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxypropanoyl]amino]propanoate Traditional Name: 3-[[(2S)-2-(2-keto-3,4,7-trimethyl-chromen-5-yl)oxypropanoyl]amino]propionate Formula: C18H20NO6- MolecularWeight: 346.3545

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(C)C(=O)NCCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)O[C@@H](C)C(=O)NCCC(=O)[O-]

InChI

InChI=1S/C18H21NO6/c1-9-7-13(24-12(4)17(22)19-6-5-15(20)21)16-10(2)11(3)18(23)25-14(16)8-9/h7-8,12H,5-6H2,1-4H3,(H,19,22)(H,20,21)/p-1/t12-/m0/s1