4-[[2-[6-chloranyl-4-methyl-7-(3-methylbut-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-[6-chloranyl-4-methyl-7-(3-methylbut-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[2-[6-chloro-4-methyl-7-(3-methylbut-2-enoxy)-2-oxo-chromen-3-yl]acetyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[2-[6-chloro-4-methyl-7-(3-methylbut-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[2-[6-chloro-4-methyl-7-(3-methylbut-2-enoxy)-2-oxochromen-3-yl]acetyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[2-[6-chloro-2-keto-4-methyl-7-(3-methylbut-2-enoxy)chromen-3-yl]acetyl]amino]methyl]cyclohexanecarboxylic acid Formula: C25H30ClNO6 MolecularWeight: 475.9618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30ClNO6/c1-14(2)8-9-32-22-12-21-18(10-20(22)26)15(3)19(25(31)33-21)11-23(28)27-13-16-4-6-17(7-5-16)24(29)30/h8,10,12,16-17H,4-7,9,11,13H2,1-3H3,(H,27,28)(H,29,30)