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

Systemtic Name: (2S)-2-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]propanoylamino]propanoic acid Openeye Name: (2S)-2-[3-[4-methyl-7-(2-methylallyloxy)-2-oxo-chromen-3-yl]propanoylamino]propanoic acid CAS Name: (2S)-2-[[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-2-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]propanoylamino]propanoic acid Traditional Name: (2S)-2-[3-[2-keto-4-methyl-7-(2-methylallyloxy)chromen-3-yl]propanoylamino]propionic acid Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO6/c1-11(2)10-26-14-5-6-15-12(3)16(20(25)27-17(15)9-14)7-8-18(22)21-13(4)19(23)24/h5-6,9,13H,1,7-8,10H2,2-4H3,(H,21,22)(H,23,24)/t13-/m0/s1