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

Systemtic Name: 3-methyl-2-[2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[[2-(2-oxo-4-propyl-chromen-7-yl)oxyacetyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[(2-oxo-4-propyl-1-benzopyran-7-yl)oxy]ethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-(2-oxo-4-propylchromen-7-yl)oxyacetyl]amino]pentanoic acid Traditional Name: 2-[[2-(2-keto-4-propyl-chromen-7-yl)oxyacetyl]amino]-3-methyl-valeric acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(C(C)CC)C(=O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(C(C)CC)C(=O)O

InChI

InChI=1S/C20H25NO6/c1-4-6-13-9-18(23)27-16-10-14(7-8-15(13)16)26-11-17(22)21-19(20(24)25)12(3)5-2/h7-10,12,19H,4-6,11H2,1-3H3,(H,21,22)(H,24,25)