4-[[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[2-(4,7-dimethyl-2-oxo-chromen-5-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[2-[(4,7-dimethyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[2-(4,7-dimethyl-2-oxochromen-5-yl)oxyacetyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[2-(2-keto-4,7-dimethyl-chromen-5-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate Formula: C21H24NO6- MolecularWeight: 386.41836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C21H25NO6/c1-12-7-16(20-13(2)9-19(24)28-17(20)8-12)27-11-18(23)22-10-14-3-5-15(6-4-14)21(25)26/h7-9,14-15H,3-6,10-11H2,1-2H3,(H,22,23)(H,25,26)/p-1