3-[2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]propanoic acid

Systemtic Name: 3-[2-(8-methyl-2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]propanoic acid Openeye Name: 3-[[2-(8-methyl-2-oxo-4-propyl-chromen-7-yl)oxyacetyl]amino]propanoic acid CAS Name: 3-[[2-[(8-methyl-2-oxo-4-propyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(8-methyl-2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]propanoic acid Traditional Name: 3-[[2-(2-keto-8-methyl-4-propyl-chromen-7-yl)oxyacetyl]amino]propionic acid Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NCCC(=O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NCCC(=O)O

InChI

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