8-tert-butyl-6-cyclohexyl-3-ethanoyl-chromen-2-one

Systemtic Name: 8-tert-butyl-6-cyclohexyl-3-ethanoyl-chromen-2-one Openeye Name: 3-acetyl-8-tert-butyl-6-cyclohexyl-chromen-2-one CAS Name: 3-acetyl-8-tert-butyl-6-cyclohexyl-1-benzopyran-2-one IUPAC Name: 3-acetyl-8-tert-butyl-6-cyclohexylchromen-2-one Traditional Name: 3-acetyl-8-tert-butyl-6-cyclohexyl-coumarin Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=CC(=CC(=C2OC1=O)C(C)(C)C)C3CCCCC3

Isomeric SMILES

CC(=O)C1=CC2=CC(=CC(=C2OC1=O)C(C)(C)C)C3CCCCC3

InChI

InChI=1S/C21H26O3/c1-13(22)17-11-16-10-15(14-8-6-5-7-9-14)12-18(21(2,3)4)19(16)24-20(17)23/h10-12,14H,5-9H2,1-4H3