(2R)-3-methyl-2-[2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]pentanoic acid

Systemtic Name: (2R)-3-methyl-2-[2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]pentanoic acid Openeye Name: (2R)-3-methyl-2-[[2-(3,4,7-trimethyl-2-oxo-chromen-5-yl)oxyacetyl]amino]pentanoic acid CAS Name: (2R)-3-methyl-2-[[1-oxo-2-[(3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl)oxy]ethyl]amino]pentanoic acid IUPAC Name: (2R)-3-methyl-2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]pentanoic acid Traditional Name: (2R)-2-[[2-(2-keto-3,4,7-trimethyl-chromen-5-yl)oxyacetyl]amino]-3-methyl-valeric acid Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)COC1=CC(=CC2=C1C(=C(C(=O)O2)C)C)C

Isomeric SMILES

CCC(C)[C@H](C(=O)O)NC(=O)COC1=CC(=CC2=C1C(=C(C(=O)O2)C)C)C

InChI

InChI=1S/C20H25NO6/c1-6-11(3)18(19(23)24)21-16(22)9-26-14-7-10(2)8-15-17(14)12(4)13(5)20(25)27-15/h7-8,11,18H,6,9H2,1-5H3,(H,21,22)(H,23,24)/t11?,18-/m1/s1