3-[2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCCC(=O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NCCC(=O)O

InChI

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