3-[[(2S)-2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]propanoate

Systemtic Name: 3-[[(2S)-2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]propanoate Openeye Name: 3-[[(2S)-2-(3,4,8-trimethyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]propanoate CAS Name: 3-[[(2S)-1-oxo-2-[(3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl)oxy]propyl]amino]propanoate IUPAC Name: 3-[[(2S)-2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxypropanoyl]amino]propanoate Traditional Name: 3-[[(2S)-2-(2-keto-3,4,8-trimethyl-chromen-7-yl)oxypropanoyl]amino]propionate Formula: C18H20NO6- MolecularWeight: 346.3545

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NCCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O[C@@H](C)C(=O)NCCC(=O)[O-])C

InChI

InChI=1S/C18H21NO6/c1-9-10(2)18(23)25-16-11(3)14(6-5-13(9)16)24-12(4)17(22)19-8-7-15(20)21/h5-6,12H,7-8H2,1-4H3,(H,19,22)(H,20,21)/p-1/t12-/m0/s1