(2S)-2-[2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoic acid

Systemtic Name: (2S)-2-[2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoic acid Openeye Name: (2S)-2-[[2-[4-methyl-7-(2-methylallyloxy)-2-oxo-chromen-3-yl]acetyl]amino]propanoic acid CAS Name: (2S)-2-[[2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxoethyl]amino]propanoic acid IUPAC Name: (2S)-2-[[2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]propanoic acid Traditional Name: (2S)-2-[[2-[2-keto-4-methyl-7-(2-methylallyloxy)chromen-3-yl]acetyl]amino]propionic acid Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)NC(C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)N[C@@H](C)C(=O)O

InChI

InChI=1S/C19H21NO6/c1-10(2)9-25-13-5-6-14-11(3)15(19(24)26-16(14)7-13)8-17(21)20-12(4)18(22)23/h5-7,12H,1,8-9H2,2-4H3,(H,20,21)(H,22,23)/t12-/m0/s1