4-[[2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: 4-[[2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[2-(4-butyl-6-chloro-2-oxo-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[2-[(4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[2-(4-butyl-6-chloro-2-oxochromen-7-yl)oxyacetyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[2-(4-butyl-6-chloro-2-keto-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate Formula: C23H27ClNO6- MolecularWeight: 448.91658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C23H28ClNO6/c1-2-3-4-16-9-22(27)31-19-11-20(18(24)10-17(16)19)30-13-21(26)25-12-14-5-7-15(8-6-14)23(28)29/h9-11,14-15H,2-8,12-13H2,1H3,(H,25,26)(H,28,29)/p-1