4-[[2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[2-(2-methyl-4-oxo-3-phenoxy-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[2-[(2-methyl-4-oxo-3-phenoxy-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[2-(4-keto-2-methyl-3-phenoxy-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylic acid Formula: C26H27NO7 MolecularWeight: 465.49508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCC3CCC(CC3)C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCC3CCC(CC3)C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C26H27NO7/c1-16-25(34-19-5-3-2-4-6-19)24(29)21-12-11-20(13-22(21)33-16)32-15-23(28)27-14-17-7-9-18(10-8-17)26(30)31/h2-6,11-13,17-18H,7-10,14-15H2,1H3,(H,27,28)(H,30,31)