(2S)-2-[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoate

Systemtic Name: (2S)-2-[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoate Openeye Name: (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxo-chromen-3-yl]acetyl]amino]propanoate CAS Name: (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxoethyl]amino]propanoate IUPAC Name: (2S)-2-[[2-[4,8-dimethyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]propanoate Traditional Name: (2S)-2-[[2-[2-keto-4,8-dimethyl-7-(3-methylbut-2-enoxy)chromen-3-yl]acetyl]amino]propionate Formula: C21H24NO6- MolecularWeight: 386.41836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC=C(C)C)CC(=O)NC(C)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6/c1-11(2)8-9-27-17-7-6-15-12(3)16(21(26)28-19(15)13(17)4)10-18(23)22-14(5)20(24)25/h6-8,14H,9-10H2,1-5H3,(H,22,23)(H,24,25)/p-1/t14-/m0/s1