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

Systemtic Name: 4-[[2-(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylate Openeye Name: 4-[[[2-(6-chloro-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate CAS Name: 4-[[[2-[(6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylate IUPAC Name: 4-[[[2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[[[2-(6-chloro-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylate Formula: C20H21ClNO6- MolecularWeight: 406.83684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C20H22ClNO6/c1-11-6-19(24)28-16-8-17(15(21)7-14(11)16)27-10-18(23)22-9-12-2-4-13(5-3-12)20(25)26/h6-8,12-13H,2-5,9-10H2,1H3,(H,22,23)(H,25,26)/p-1