6,8,8-triethyl-5-oxidanyl-3-phenyl-chromene-4,7-dione

Systemtic Name: 6,8,8-triethyl-5-oxidanyl-3-phenyl-chromene-4,7-dione Openeye Name: 6,8,8-triethyl-5-hydroxy-3-phenyl-chromene-4,7-dione CAS Name: 6,8,8-triethyl-5-hydroxy-3-phenyl-1-benzopyran-4,7-dione IUPAC Name: 6,8,8-triethyl-5-hydroxy-3-phenylchromene-4,7-dione Traditional Name: 6,8,8-triethyl-5-hydroxy-3-phenyl-chromene-4,7-quinone Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(C1=O)(CC)CC)OC=C(C2=O)C3=CC=CC=C3)O

Isomeric SMILES

CCC1=C(C2=C(C(C1=O)(CC)CC)OC=C(C2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H22O4/c1-4-14-17(22)16-18(23)15(13-10-8-7-9-11-13)12-25-20(16)21(5-2,6-3)19(14)24/h7-12,22H,4-6H2,1-3H3