2-[(3R)-3-methyl-3-oxidanyl-4-phenylmethoxy-butyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[(3R)-3-methyl-3-oxidanyl-4-phenylmethoxy-butyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[(3R)-4-benzyloxy-3-hydroxy-3-methyl-butyl]-1,4-benzoquinone CAS Name: 2-[(3R)-3-hydroxy-3-methyl-4-phenylmethoxybutyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[(3R)-3-hydroxy-3-methyl-4-phenylmethoxybutyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[(3R)-4-benzoxy-3-hydroxy-3-methyl-butyl]-p-benzoquinone Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=O)C=CC1=O)(COCC2=CC=CC=C2)O

Isomeric SMILES

C[C@@](CCC1=CC(=O)C=CC1=O)(COCC2=CC=CC=C2)O

InChI

InChI=1S/C18H20O4/c1-18(21,13-22-12-14-5-3-2-4-6-14)10-9-15-11-16(19)7-8-17(15)20/h2-8,11,21H,9-10,12-13H2,1H3/t18-/m1/s1