6-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]hexanoic acid

Systemtic Name: 6-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]hexanoic acid Openeye Name: 6-[[2-(3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]hexanoic acid CAS Name: 6-[[2-[[4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]hexanoic acid Traditional Name: 6-[[2-(3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl)oxyacetyl]amino]hexanoic acid Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NCCCCCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)NCCCCCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-17-20-12-13-22(32-16-23(28)27-14-8-4-7-11-24(29)30)18(2)25(20)33-26(31)21(17)15-19-9-5-3-6-10-19/h3,5-6,9-10,12-13H,4,7-8,11,14-16H2,1-2H3,(H,27,28)(H,29,30)