4-[[2-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[2-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[2-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[2-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[2-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)acetyl]amino]methyl]cyclohexanecarboxylic acid Formula: C26H31NO6 MolecularWeight: 453.52744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CC(=O)NCC4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CC(=O)NCC4CCC(CC4)C(=O)O

InChI

InChI=1S/C26H31NO6/c1-14-17-9-19-20(26(2,3)4)13-32-21(19)11-22(17)33-25(31)18(14)10-23(28)27-12-15-5-7-16(8-6-15)24(29)30/h9,11,13,15-16H,5-8,10,12H2,1-4H3,(H,27,28)(H,29,30)